Vitas-M small molecule compound
2-amino-1-(4-chlorophenyl)-4-[4-(morpholin-4-ylmethyl)thiophen-2-yl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK780635
SMILES N#CC1=C(N)N(c2ccc(cc2)Cl)C2=C(C1c1scc(c1)CN1CCOCC1)C(=O)CCC2
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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 C25H25ClN4O2S MW 481.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN4O2S/c26-17-4-6-18(7-5-17)30-20-2-1-3-21(31)24(20)23(19(13-27)25(30)28)22-12-16(15-33-22)14-29-8-10-32-11-9-29/h4-7,12,15,23H,1-3,8-11,14,28H2InChIKey
AETXPDYNWWTFQK-UHFFFAOYSA-NSynonyms
2amino1(4chlorophenyl)4(4(morpholin4ylmethyl)thiophen2yl)5oxo145678hexahydroquinoline3carbonitrile
2amino1(4chlorophenyl)4(4(morpholin4ylmethyl)thiophen2yl)5oxo4678tetrahydroquinoline3carbonitrile
C1CC2=C(C(C(=C(N2C3=CC=C(C=C3)Cl)N)C#N)C4=CC(=CS4)CN5CCOCC5)C(=O)C1
InChI=1SC25H25ClN4O2Sc26174618(7517)302021321(31)24(20)23(19(1327)25(30)28)221216(153322)14298103211929h47121523H138111428H2
MFCD06013442
ZINC000019874238
ZINC000019874240
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