3-(4-chloranyl-2-methyl-phenyl)-1-[(2-chlorophenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea

Systemtic Name: 3-(4-chloranyl-2-methyl-phenyl)-1-[(2-chlorophenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea Openeye Name: 3-(4-chloro-2-methyl-phenyl)-1-[(2-chlorophenyl)methyl]-1-(1-methyl-4-piperidyl)thiourea CAS Name: 3-(4-chloro-2-methylphenyl)-1-[(2-chlorophenyl)methyl]-1-(1-methyl-4-piperidinyl)thiourea IUPAC Name: 3-(4-chloro-2-methylphenyl)-1-[(2-chlorophenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea Traditional Name: 1-(2-chlorobenzyl)-3-(4-chloro-2-methyl-phenyl)-1-(1-methyl-4-piperidyl)thiourea Formula: C21H25Cl2N3S MolecularWeight: 422.4143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=S)N(CC2=CC=CC=C2Cl)C3CCN(CC3)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=S)N(CC2=CC=CC=C2Cl)C3CCN(CC3)C

InChI

InChI=1S/C21H25Cl2N3S/c1-15-13-17(22)7-8-20(15)24-21(27)26(18-9-11-25(2)12-10-18)14-16-5-3-4-6-19(16)23/h3-8,13,18H,9-12,14H2,1-2H3,(H,24,27)