1-[(3-chlorophenyl)methyl]-3-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-[(3-chlorophenyl)methyl]-3-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-[(3-chlorophenyl)methyl]-3-[4-[(3-methyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-[(3-chlorophenyl)methyl]-3-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-[(3-chlorophenyl)methyl]-3-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(3-chlorobenzyl)-3-[4-(3-methylpiperidino)sulfonylphenyl]thiourea Formula: C20H24ClN3O2S2 MolecularWeight: 438.00646

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H24ClN3O2S2/c1-15-4-3-11-24(14-15)28(25,26)19-9-7-18(8-10-19)23-20(27)22-13-16-5-2-6-17(21)12-16/h2,5-10,12,15H,3-4,11,13-14H2,1H3,(H2,22,23,27)