1-(4-butylphenyl)-3-[(4-dimethylaminophenyl)methyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(4-dimethylaminophenyl)methyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(4-dimethylaminophenyl)methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[(4-dimethylaminophenyl)methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(4-dimethylaminophenyl)methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[4-(dimethylamino)benzyl]thiourea Formula: C20H27N3S MolecularWeight: 341.51348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H27N3S/c1-4-5-6-16-7-11-18(12-8-16)22-20(24)21-15-17-9-13-19(14-10-17)23(2)3/h7-14H,4-6,15H2,1-3H3,(H2,21,22,24)