1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclopentyl-3-(4-ethoxyphenyl)-1-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclopentyl-1-[(2-keto-7-methoxy-1H-quinolin-3-yl)methyl]-3-p-phenetyl-thiourea Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC3=C(C=C(C=C3)OC)NC2=O)C4CCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N(CC2=CC3=C(C=C(C=C3)OC)NC2=O)C4CCCC4

InChI

InChI=1S/C25H29N3O3S/c1-3-31-21-12-9-19(10-13-21)26-25(32)28(20-6-4-5-7-20)16-18-14-17-8-11-22(30-2)15-23(17)27-24(18)29/h8-15,20H,3-7,16H2,1-2H3,(H,26,32)(H,27,29)