3-(2,5-dimethylphenyl)-1-(3-ethoxypropyl)-1-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methyl]thiourea

Systemtic Name: 3-(2,5-dimethylphenyl)-1-(3-ethoxypropyl)-1-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methyl]thiourea Openeye Name: 3-(2,5-dimethylphenyl)-1-(3-ethoxypropyl)-1-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methyl]thiourea CAS Name: 3-(2,5-dimethylphenyl)-1-(3-ethoxypropyl)-1-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methyl]thiourea IUPAC Name: 3-(2,5-dimethylphenyl)-1-(3-ethoxypropyl)-1-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methyl]thiourea Traditional Name: 3-(2,5-dimethylphenyl)-1-(3-ethoxypropyl)-1-[(1-propyl-3,4-dihydro-2H-quinolin-6-yl)methyl]thiourea Formula: C27H39N3OS MolecularWeight: 453.68306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCC2=C1C=CC(=C2)CN(CCCOCC)C(=S)NC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCN1CCCC2=C1C=CC(=C2)CN(CCCOCC)C(=S)NC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C27H39N3OS/c1-5-14-29-15-7-9-24-19-23(12-13-26(24)29)20-30(16-8-17-31-6-2)27(32)28-25-18-21(3)10-11-22(25)4/h10-13,18-19H,5-9,14-17,20H2,1-4H3,(H,28,32)