1,3-dicyclohexyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1,3-dicyclohexyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1,3-dicyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1,3-dicyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1,3-dicyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1,3-dicyclohexyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C25H35N3O3S MolecularWeight: 457.6287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(C3CCCCC3)C(=S)NC4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=O)N2)CN(C3CCCCC3)C(=S)NC4CCCCC4)OC

InChI

InChI=1S/C25H35N3O3S/c1-30-22-14-17-13-18(24(29)27-21(17)15-23(22)31-2)16-28(20-11-7-4-8-12-20)25(32)26-19-9-5-3-6-10-19/h13-15,19-20H,3-12,16H2,1-2H3,(H,26,32)(H,27,29)