1-(2,3-dimethylphenyl)-3-[[2-(piperidin-1-ylmethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[[2-(piperidin-1-ylmethyl)phenyl]methyl]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[[2-(1-piperidylmethyl)phenyl]methyl]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[[2-(1-piperidinylmethyl)phenyl]methyl]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[[2-(piperidin-1-ylmethyl)phenyl]methyl]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[2-(piperidinomethyl)benzyl]thiourea Formula: C22H29N3S MolecularWeight: 367.55076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NCC2=CC=CC=C2CN3CCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NCC2=CC=CC=C2CN3CCCCC3)C

InChI

InChI=1S/C22H29N3S/c1-17-9-8-12-21(18(17)2)24-22(26)23-15-19-10-4-5-11-20(19)16-25-13-6-3-7-14-25/h4-5,8-12H,3,6-7,13-16H2,1-2H3,(H2,23,24,26)