1-[(2-chlorophenyl)methyl]-3-(2,6-dimethylphenyl)-1-(1-methylpiperidin-4-yl)thiourea

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-(2,6-dimethylphenyl)-1-(1-methylpiperidin-4-yl)thiourea Openeye Name: 1-[(2-chlorophenyl)methyl]-3-(2,6-dimethylphenyl)-1-(1-methyl-4-piperidyl)thiourea CAS Name: 1-[(2-chlorophenyl)methyl]-3-(2,6-dimethylphenyl)-1-(1-methyl-4-piperidinyl)thiourea IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-(2,6-dimethylphenyl)-1-(1-methylpiperidin-4-yl)thiourea Traditional Name: 1-(2-chlorobenzyl)-3-(2,6-dimethylphenyl)-1-(1-methyl-4-piperidyl)thiourea Formula: C22H28ClN3S MolecularWeight: 401.99582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28ClN3S/c1-16-7-6-8-17(2)21(16)24-22(27)26(19-11-13-25(3)14-12-19)15-18-9-4-5-10-20(18)23/h4-10,19H,11-15H2,1-3H3,(H,24,27)