1-[[1-(4-tert-butylphenyl)sulfonylpiperidin-4-yl]carbonylamino]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[[1-(4-tert-butylphenyl)sulfonylpiperidin-4-yl]carbonylamino]-3-(2-methylphenyl)thiourea Openeye Name: 1-[[1-(4-tert-butylphenyl)sulfonylpiperidine-4-carbonyl]amino]-3-(o-tolyl)thiourea CAS Name: 1-[[[1-(4-tert-butylphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[[1-(4-tert-butylphenyl)sulfonylpiperidine-4-carbonyl]amino]-3-(2-methylphenyl)thiourea Traditional Name: 1-[[1-(4-tert-butylphenyl)sulfonylisonipecotoyl]amino]-3-(o-tolyl)thiourea Formula: C24H32N4O3S2 MolecularWeight: 488.66588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C24H32N4O3S2/c1-17-7-5-6-8-21(17)25-23(32)27-26-22(29)18-13-15-28(16-14-18)33(30,31)20-11-9-19(10-12-20)24(2,3)4/h5-12,18H,13-16H2,1-4H3,(H,26,29)(H2,25,27,32)