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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCC2=C1C=CC(=C2)CN(CCCOCC)C(=S)NC3=CC=CC(=C3C)C

Isomeric SMILES

CCCN1CCCC2=C1C=CC(=C2)CN(CCCOCC)C(=S)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C27H39N3OS/c1-5-15-29-16-8-11-24-19-23(13-14-26(24)29)20-30(17-9-18-31-6-2)27(32)28-25-12-7-10-21(3)22(25)4/h7,10,12-14,19H,5-6,8-9,11,15-18,20H2,1-4H3,(H,28,32)