1-[(4-dimethylaminophenyl)methyl]-3-(3-methylphenyl)-1-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[(4-dimethylaminophenyl)methyl]-3-(3-methylphenyl)-1-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[(4-dimethylaminophenyl)methyl]-3-(m-tolyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[(4-dimethylaminophenyl)methyl]-3-(3-methylphenyl)-1-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[(4-dimethylaminophenyl)methyl]-3-(3-methylphenyl)-1-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[4-(dimethylamino)benzyl]-3-(m-tolyl)-1-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C22H29N3OS MolecularWeight: 383.55016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)N(CC2CCCO2)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)N(C[C@H]2CCCO2)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H29N3OS/c1-17-6-4-7-19(14-17)23-22(27)25(16-21-8-5-13-26-21)15-18-9-11-20(12-10-18)24(2)3/h4,6-7,9-12,14,21H,5,8,13,15-16H2,1-3H3,(H,23,27)/t21-/m1/s1