Vitas-M small molecule compound
N-[(2-{4-[(4-chlorophenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]-3-(2-methylpropoxy)benzamide
Catalog ID
STK254244
SMILES CC(COc1cccc(c1)C(=O)NC(=S)Nc1ccccc1N1CCN(CC1)C(=O)c1ccc(cc1)Cl)C
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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 C29H31ClN4O3S MW 551.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31ClN4O3S/c1-20(2)19-37-24-7-5-6-22(18-24)27(35)32-29(38)31-25-8-3-4-9-26(25)33-14-16-34(17-15-33)28(36)21-10-12-23(30)13-11-21/h3-13,18,20H,14-17,19H2,1-2H3,(H2,31,32,35,38)InChIKey
ZVDOTPWNIVBSFY-UHFFFAOYSA-NSynonyms
CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCN(CC3)C(=O)C4=CC=C(C=C4)Cl
InChI=1SC29H31ClN4O3Sc120(2)19372475622(1824)27(35)3229(38)3125834926(25)33141634(171533)28(36)21101223(30)131121h3131820H141719H212H3(H231323538)
MFCD04966608
N((2(4((4chlorophenyl)carbonyl)piperazin1yl)phenyl)carbamothioyl)3(2methylpropoxy)benzamide
N((2(4(4CHLOROBENZOYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)3(2METHYLPROPOXY)BENZAMIDE
ZINC000004122787
ZINC4122787
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