1-(2,4-dichlorophenyl)-3-[[1-(phenylsulfonyl)piperidin-3-yl]carbonylamino]thiourea

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[[1-(phenylsulfonyl)piperidin-3-yl]carbonylamino]thiourea Openeye Name: 1-[[1-(benzenesulfonyl)piperidine-3-carbonyl]amino]-3-(2,4-dichlorophenyl)thiourea CAS Name: 1-[[[1-(benzenesulfonyl)-3-piperidinyl]-oxomethyl]amino]-3-(2,4-dichlorophenyl)thiourea IUPAC Name: 1-[[1-(benzenesulfonyl)piperidine-3-carbonyl]amino]-3-(2,4-dichlorophenyl)thiourea Traditional Name: 1-[(1-besylnipecotoyl)amino]-3-(2,4-dichlorophenyl)thiourea Formula: C19H20Cl2N4O3S2 MolecularWeight: 487.4231

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NNC(=S)NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NNC(=S)NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H20Cl2N4O3S2/c20-14-8-9-17(16(21)11-14)22-19(29)24-23-18(26)13-5-4-10-25(12-13)30(27,28)15-6-2-1-3-7-15/h1-3,6-9,11,13H,4-5,10,12H2,(H,23,26)(H2,22,24,29)