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

Systemtic Name: 1-cyclopentyl-1-[(6-ethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-cyclopentyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea CAS Name: 1-cyclopentyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-cyclopentyl-1-[(6-ethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-cyclopentyl-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)thiourea Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C3CCCC3)C(=S)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H29N3O2S/c1-3-17-8-13-23-18(14-17)15-19(24(29)27-23)16-28(21-6-4-5-7-21)25(31)26-20-9-11-22(30-2)12-10-20/h8-15,21H,3-7,16H2,1-2H3,(H,26,31)(H,27,29)