1-(3,4-dimethylphenyl)-3-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]carbonylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]carbonylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[[1-(4-methoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[[1-(4-methoxyphenyl)sulfonylpiperidine-4-carbonyl]amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[[1-(4-methoxyphenyl)sulfonylisonipecotoyl]amino]thiourea Formula: C22H28N4O4S2 MolecularWeight: 476.61212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H28N4O4S2/c1-15-4-5-18(14-16(15)2)23-22(31)25-24-21(27)17-10-12-26(13-11-17)32(28,29)20-8-6-19(30-3)7-9-20/h4-9,14,17H,10-13H2,1-3H3,(H,24,27)(H2,23,25,31)