1-cyclohexyl-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-cyclohexyl-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-cyclohexyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-cyclohexyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-cyclohexyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-cyclohexyl-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCCC3)C(=S)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H31N3O2S/c1-3-18-9-14-24-19(15-18)16-20(25(30)28-24)17-29(22-7-5-4-6-8-22)26(32)27-21-10-12-23(31-2)13-11-21/h9-16,22H,3-8,17H2,1-2H3,(H,27,32)(H,28,30)