1-[(2-chlorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-(1-methylpiperidin-4-yl)thiourea

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-(1-methylpiperidin-4-yl)thiourea Openeye Name: 1-[(2-chlorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-(1-methyl-4-piperidyl)thiourea CAS Name: 1-[(2-chlorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-(1-methyl-4-piperidinyl)thiourea IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-(3,4-dimethoxyphenyl)-1-(1-methylpiperidin-4-yl)thiourea Traditional Name: 1-(2-chlorobenzyl)-3-(3,4-dimethoxyphenyl)-1-(1-methyl-4-piperidyl)thiourea Formula: C22H28ClN3O2S MolecularWeight: 433.99462

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(CC2=CC=CC=C2Cl)C(=S)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1CCC(CC1)N(CC2=CC=CC=C2Cl)C(=S)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H28ClN3O2S/c1-25-12-10-18(11-13-25)26(15-16-6-4-5-7-19(16)23)22(29)24-17-8-9-20(27-2)21(14-17)28-3/h4-9,14,18H,10-13,15H2,1-3H3,(H,24,29)