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

Systemtic Name: 1-cyclopentyl-1-[(6,7-dimethoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea Openeye Name: 1-cyclopentyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea CAS Name: 1-cyclopentyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea IUPAC Name: 1-cyclopentyl-1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]-3-(3-methoxypropyl)thiourea Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)N(CC1=CC2=CC(=C(C=C2NC1=O)OC)OC)C3CCCC3

Isomeric SMILES

COCCCNC(=S)N(CC1=CC2=CC(=C(C=C2NC1=O)OC)OC)C3CCCC3

InChI

InChI=1S/C22H31N3O4S/c1-27-10-6-9-23-22(30)25(17-7-4-5-8-17)14-16-11-15-12-19(28-2)20(29-3)13-18(15)24-21(16)26/h11-13,17H,4-10,14H2,1-3H3,(H,23,30)(H,24,26)