3-(2-chloranyl-5-methoxy-phenyl)-1-(1-methylpiperidin-4-yl)-1-phenethyl-thiourea

Systemtic Name: 3-(2-chloranyl-5-methoxy-phenyl)-1-(1-methylpiperidin-4-yl)-1-phenethyl-thiourea Openeye Name: 3-(2-chloro-5-methoxy-phenyl)-1-(1-methyl-4-piperidyl)-1-phenethyl-thiourea CAS Name: 3-(2-chloro-5-methoxyphenyl)-1-(1-methyl-4-piperidinyl)-1-phenethylthiourea IUPAC Name: 3-(2-chloro-5-methoxyphenyl)-1-(1-methylpiperidin-4-yl)-1-phenethylthiourea Traditional Name: 3-(2-chloro-5-methoxy-phenyl)-1-(1-methyl-4-piperidyl)-1-phenethyl-thiourea Formula: C22H28ClN3OS MolecularWeight: 417.99522

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(CCC2=CC=CC=C2)C(=S)NC3=C(C=CC(=C3)OC)Cl

Isomeric SMILES

CN1CCC(CC1)N(CCC2=CC=CC=C2)C(=S)NC3=C(C=CC(=C3)OC)Cl

InChI

InChI=1S/C22H28ClN3OS/c1-25-13-11-18(12-14-25)26(15-10-17-6-4-3-5-7-17)22(28)24-21-16-19(27-2)8-9-20(21)23/h3-9,16,18H,10-15H2,1-2H3,(H,24,28)