1-(4-butylphenyl)-3-[[2-(dimethylaminomethyl)phenyl]methyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[[2-(dimethylaminomethyl)phenyl]methyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[[2-(dimethylaminomethyl)phenyl]methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[[2-(dimethylaminomethyl)phenyl]methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[[2-(dimethylaminomethyl)phenyl]methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[2-(dimethylaminomethyl)benzyl]thiourea Formula: C21H29N3S MolecularWeight: 355.54006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2CN(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=CC=C2CN(C)C

InChI

InChI=1S/C21H29N3S/c1-4-5-8-17-11-13-20(14-12-17)23-21(25)22-15-18-9-6-7-10-19(18)16-24(2)3/h6-7,9-14H,4-5,8,15-16H2,1-3H3,(H2,22,23,25)