3-(2-chloranyl-5-methyl-phenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea

Systemtic Name: 3-(2-chloranyl-5-methyl-phenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea Openeye Name: 3-(2-chloro-5-methyl-phenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methyl-4-piperidyl)thiourea CAS Name: 3-(2-chloro-5-methylphenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methyl-4-piperidinyl)thiourea IUPAC Name: 3-(2-chloro-5-methylphenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea Traditional Name: 3-(2-chloro-5-methyl-phenyl)-1-(1-methyl-4-piperidyl)-1-o-anisyl-thiourea Formula: C22H28ClN3OS MolecularWeight: 417.99522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC(=S)N(CC2=CC=CC=C2OC)C3CCN(CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC(=S)N(CC2=CC=CC=C2OC)C3CCN(CC3)C

InChI

InChI=1S/C22H28ClN3OS/c1-16-8-9-19(23)20(14-16)24-22(28)26(18-10-12-25(2)13-11-18)15-17-6-4-5-7-21(17)27-3/h4-9,14,18H,10-13,15H2,1-3H3,(H,24,28)