1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-(2,6-dimethylphenyl)thiourea

Systemtic Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-(2,6-dimethylphenyl)thiourea Openeye Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-(2,6-dimethylphenyl)thiourea CAS Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-(2,6-dimethylphenyl)thiourea IUPAC Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-(2,6-dimethylphenyl)thiourea Traditional Name: 1-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-3-(2,6-dimethylphenyl)thiourea Formula: C21H27N3S MolecularWeight: 353.52418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NCCCN2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NCCCN2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H27N3S/c1-16-7-5-8-17(2)20(16)23-21(25)22-12-6-13-24-14-11-18-9-3-4-10-19(18)15-24/h3-5,7-10H,6,11-15H2,1-2H3,(H2,22,23,25)