1-cyclopentyl-1-[(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-methylsulfanylphenyl)thiourea

Systemtic Name: 1-cyclopentyl-1-[(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-methylsulfanylphenyl)thiourea Openeye Name: 1-cyclopentyl-1-[(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-methylsulfanylphenyl)thiourea CAS Name: 1-cyclopentyl-1-[(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-[3-(methylthio)phenyl]thiourea IUPAC Name: 1-cyclopentyl-1-[(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-(3-methylsulfanylphenyl)thiourea Traditional Name: 1-cyclopentyl-1-[(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methyl]-3-[3-(methylthio)phenyl]thiourea Formula: C25H33N3S2 MolecularWeight: 439.67962

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC2=C1C=CC(=C2)CN(C3CCCC3)C(=S)NC4=CC(=CC=C4)SC

Isomeric SMILES

CCN1CCCC2=C1C=CC(=C2)CN(C3CCCC3)C(=S)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C25H33N3S2/c1-3-27-15-7-8-20-16-19(13-14-24(20)27)18-28(22-10-4-5-11-22)25(29)26-21-9-6-12-23(17-21)30-2/h6,9,12-14,16-17,22H,3-5,7-8,10-11,15,18H2,1-2H3,(H,26,29)