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

Systemtic Name: 3-butyl-1-cyclohexyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 3-butyl-1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 3-butyl-1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-butyl-1-cyclohexyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 3-butyl-1-cyclohexyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]thiourea Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(CC1=CC2=CC(=C(C=C2NC1=O)OC)OC)C3CCCCC3

Isomeric SMILES

CCCCNC(=S)N(CC1=CC2=CC(=C(C=C2NC1=O)OC)OC)C3CCCCC3

InChI

InChI=1S/C23H33N3O3S/c1-4-5-11-24-23(30)26(18-9-7-6-8-10-18)15-17-12-16-13-20(28-2)21(29-3)14-19(16)25-22(17)27/h12-14,18H,4-11,15H2,1-3H3,(H,24,30)(H,25,27)