Vitas-M small molecule compound
ethyl (2Z)-2-(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-5-[(E)-2-phenylethenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK794307
SMILES CCCCN1c2ccccc2/C(=c\2/sc3=NC(=C(C(n3c2=O)/C=C/c2ccccc2)C(=O)OCC)C)/C1=O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H29N3O4S MW 527.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O4S/c1-4-6-18-32-22-15-11-10-14-21(22)25(27(32)34)26-28(35)33-23(17-16-20-12-8-7-9-13-20)24(29(36)37-5-2)19(3)31-30(33)38-26/h7-17,23H,4-6,18H2,1-3H3/b17-16+,26-25-InChIKey
MRPOTHXTANKAHP-AZJKVRHGSA-NSynonyms
372493-89-5(Z)ethyl2(1butyl2oxoindolin3ylidene)7methyl3oxo5((E)styryl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
372493895
CCCCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC)C=CC5=CC=CC=C5)C1=O
CCCCN1c2ccccc2C(=c2sc3=NC(=C(C(n3c2=O)C=Cc2ccccc2)C(=O)OCC)C)C1=O
ethyl(2Z)2(1butyl2oxo12dihydro3Hindol3ylidene)7methyl3oxo5((E)2phenylethenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(1BUTYL2OXOINDOL3YLIDENE)7METHYL3OXO5((E)2PHENYLETHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H29N3O4Sc1461832221511101421(22)25(27(32)34)2628(35)3323(171620128791320)24(29(36)3752)19(3)3130(33)3826h71723H4618H213H3b1716+2625
MFCD01942604
ZINC000009183467
ZINC000009183468
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