1-cyclopentyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-cyclopentyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclopentyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclopentyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclopentyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclopentyl-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-3-homoveratryl-thiourea Formula: C28H35N3O3S MolecularWeight: 493.6608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C28H35N3O3S/c1-4-19-9-11-24-21(15-19)17-22(27(32)30-24)18-31(23-7-5-6-8-23)28(35)29-14-13-20-10-12-25(33-2)26(16-20)34-3/h9-12,15-17,23H,4-8,13-14,18H2,1-3H3,(H,29,35)(H,30,32)