1-cyclohexyl-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea

Systemtic Name: 1-cyclohexyl-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea Openeye Name: 1-cyclohexyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea CAS Name: 1-cyclohexyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea IUPAC Name: 1-cyclohexyl-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea Traditional Name: 1-cyclohexyl-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)N(CC2=CC3=C(C=C(C=C3)OC)NC2=O)C4CCCCC4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=S)N(CC2=CC3=C(C=C(C=C3)OC)NC2=O)C4CCCCC4

InChI

InChI=1S/C26H31N3O2S/c1-18(19-9-5-3-6-10-19)27-26(32)29(22-11-7-4-8-12-22)17-21-15-20-13-14-23(31-2)16-24(20)28-25(21)30/h3,5-6,9-10,13-16,18,22H,4,7-8,11-12,17H2,1-2H3,(H,27,32)(H,28,30)