1-cyclohexyl-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea

Systemtic Name: 1-cyclohexyl-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea Openeye Name: 1-cyclohexyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea CAS Name: 1-cyclohexyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea IUPAC Name: 1-cyclohexyl-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea Traditional Name: 1-cyclohexyl-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-(1-phenylethyl)thiourea Formula: C26H31N3OS MolecularWeight: 433.60884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C26H31N3OS/c1-18-13-14-24-21(15-18)16-22(25(30)28-24)17-29(23-11-7-4-8-12-23)26(31)27-19(2)20-9-5-3-6-10-20/h3,5-6,9-10,13-16,19,23H,4,7-8,11-12,17H2,1-2H3,(H,27,31)(H,28,30)