1-(3,4-dimethylphenyl)-3-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]urea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]urea Openeye Name: 1-(3,4-dimethylphenyl)-3-[[1-(2-thienylmethyl)-4-piperidyl]methyl]urea CAS Name: 1-(3,4-dimethylphenyl)-3-[[1-(thiophen-2-ylmethyl)-4-piperidinyl]methyl]urea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]urea Traditional Name: 1-(3,4-dimethylphenyl)-3-[[1-(2-thenyl)-4-piperidyl]methyl]urea Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCC2CCN(CC2)CC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCC2CCN(CC2)CC3=CC=CS3)C

InChI

InChI=1S/C20H27N3OS/c1-15-5-6-18(12-16(15)2)22-20(24)21-13-17-7-9-23(10-8-17)14-19-4-3-11-25-19/h3-6,11-12,17H,7-10,13-14H2,1-2H3,(H2,21,22,24)