1-(3,4-dimethylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-3-yl]methyl]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-3-yl]methyl]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-3-yl]methyl]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[1-(1-phenylethyl)-3-pyrrolidinyl]methyl]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-3-yl]methyl]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[[1-(1-phenylethyl)pyrrolidin-3-yl]methyl]thiourea Formula: C22H29N3S MolecularWeight: 367.55076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NCC2CCN(C2)C(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NCC2CCN(C2)C(C)C3=CC=CC=C3)C

InChI

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