Vitas-M small molecule compound

2-{[(8E)-8-benzylidene-4-phenyl-3,4,5,6,7,8-hexahydroquinazolin-2-yl]sulfanyl}-N-methyl-N-phenylacetamide

Catalog ID
STL115137
SMILES CN(c1ccccc1)C(=O)CSC1=NC2=C(C(N1)c1ccccc1)CCC/C/2=C\c1ccccc1

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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 C30H29N3OS MW 479.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3OS/c1-33(25-17-9-4-10-18-25)27(34)21-35-30-31-28(23-14-7-3-8-15-23)26-19-11-16-24(29(26)32-30)20-22-12-5-2-6-13-22/h2-10,12-15,17-18,20,28H,11,16,19,21H2,1H3,(H,31,32)/b24-20+
InChIKey
ZTEUDNZMUKCIGW-HIXSDJFHSA-N
Synonyms

2(((8E)8benzylidene4phenyl345678hexahydroquinazolin2yl)sulfanyl)NmethylNphenylacetamide
2(((8E)8benzylidene4phenyl4567tetrahydro1Hquinazolin2yl)sulfanyl)NmethylNphenylacetamide
CN(C1=CC=CC=C1)C(=O)CSC2=NC(C3=C(N2)C(=CC4=CC=CC=C4)CCC3)C5=CC=CC=C5
CN(c1ccccc1)C(=O)CSC1=NC2=C(C(N1)c1ccccc1)CCCC2=Cc1ccccc1
InChI=1SC30H29N3OSc133(251794101825)27(34)2135303128(23147381523)2619111624(29(26)3230)2022125261322h210121517182028H11161921H21H3(H3132)b2420+
MFCD03177094
ZINC000102901859
ZINC000102901862

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Available files

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