1-(3-chlorophenyl)-3-(2-methoxy-4-piperidin-1-ylsulfonyl-phenyl)thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-(2-methoxy-4-piperidin-1-ylsulfonyl-phenyl)thiourea Openeye Name: 1-(3-chlorophenyl)-3-[2-methoxy-4-(1-piperidylsulfonyl)phenyl]thiourea CAS Name: 1-(3-chlorophenyl)-3-[2-methoxy-4-(1-piperidinylsulfonyl)phenyl]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-(2-methoxy-4-piperidin-1-ylsulfonylphenyl)thiourea Traditional Name: 1-(3-chlorophenyl)-3-(2-methoxy-4-piperidinosulfonyl-phenyl)thiourea Formula: C19H22ClN3O3S2 MolecularWeight: 439.97928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)NC(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)NC(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H22ClN3O3S2/c1-26-18-13-16(28(24,25)23-10-3-2-4-11-23)8-9-17(18)22-19(27)21-15-7-5-6-14(20)12-15/h5-9,12-13H,2-4,10-11H2,1H3,(H2,21,22,27)