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

Systemtic Name: 3-(2-chloranyl-3-methyl-phenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea Openeye Name: 3-(2-chloro-3-methyl-phenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methyl-4-piperidyl)thiourea CAS Name: 3-(2-chloro-3-methylphenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methyl-4-piperidinyl)thiourea IUPAC Name: 3-(2-chloro-3-methylphenyl)-1-[(2-methoxyphenyl)methyl]-1-(1-methylpiperidin-4-yl)thiourea Traditional Name: 3-(2-chloro-3-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=C(C(=CC=C1)NC(=S)N(CC2=CC=CC=C2OC)C3CCN(CC3)C)Cl

Isomeric SMILES

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

InChI

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