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

Systemtic Name: 1-[[1-(4-chlorophenyl)sulfonylpiperidin-3-yl]carbonylamino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[[1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[[[1-(4-chlorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[[1-(4-chlorophenyl)sulfonylpiperidine-3-carbonyl]amino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[[1-(4-chlorophenyl)sulfonylnipecotoyl]amino]-3-(3-methoxyphenyl)thiourea Formula: C20H23ClN4O4S2 MolecularWeight: 483.00402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NNC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN4O4S2/c1-29-17-6-2-5-16(12-17)22-20(30)24-23-19(26)14-4-3-11-25(13-14)31(27,28)18-9-7-15(21)8-10-18/h2,5-10,12,14H,3-4,11,13H2,1H3,(H,23,26)(H2,22,24,30)