1-(2,5-dimethylphenyl)-3-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]thiourea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]thiourea Openeye Name: 1-(2,5-dimethylphenyl)-3-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]thiourea CAS Name: 1-(2,5-dimethylphenyl)-3-[[1-(4-methoxyphenyl)-3-pyrrolidinyl]methyl]thiourea IUPAC Name: 1-(2,5-dimethylphenyl)-3-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]thiourea Traditional Name: 1-(2,5-dimethylphenyl)-3-[[1-(4-methoxyphenyl)pyrrolidin-3-yl]methyl]thiourea Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3OS/c1-15-4-5-16(2)20(12-15)23-21(26)22-13-17-10-11-24(14-17)18-6-8-19(25-3)9-7-18/h4-9,12,17H,10-11,13-14H2,1-3H3,(H2,22,23,26)