Vitas-M small molecule compound
N-methyl-2-[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Catalog ID
STK532091
SMILES CNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3
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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 C26H29N5OS MW 459.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5OS/c1-17-10-12-19(13-11-17)31-23(32)21-22(28-24(31)29-30-25(33)27-2)20-9-5-4-8-18(20)16-26(21)14-6-3-7-15-26/h4-5,8-13H,3,6-7,14-16H2,1-2H3,(H,28,29)(H2,27,30,33)InChIKey
YVGOJWBZZWAORB-UHFFFAOYSA-NSynonyms
1METHYL3((3(4METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)AMINO)THIOUREA
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2NNC(=S)NC
InChI=1SC26H29N5OSc117101219(131117)3123(32)2122(2824(31)293025(33)272)20954818(20)1626(21)146371526h45813H3671416H212H3(H2829)(H2273033)
MFCD02238065
Nmethyl2(3(4methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)hydrazinecarbothioamide
Nmethyl2(4oxo3(ptolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)hydrazinecarbothioamide
ZINC000012436968
ZINC12436968
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