N-(2-cyclopentylsulfanylphenyl)-2,5-bis(oxidanylidene)-1,6,7,8-tetrahydroquinoline-3-carboxamide

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-2,5-bis(oxidanylidene)-1,6,7,8-tetrahydroquinoline-3-carboxamide Openeye Name: N-(2-cyclopentylsulfanylphenyl)-2,5-dioxo-1,6,7,8-tetrahydroquinoline-3-carboxamide CAS Name: N-[2-(cyclopentylthio)phenyl]-2,5-dioxo-1,6,7,8-tetrahydroquinoline-3-carboxamide IUPAC Name: N-(2-cyclopentylsulfanylphenyl)-2,5-dioxo-1,6,7,8-tetrahydroquinoline-3-carboxamide Traditional Name: N-[2-(cyclopentylthio)phenyl]-2,5-diketo-1,6,7,8-tetrahydroquinoline-3-carboxamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=CC=C2NC(=O)C3=CC4=C(CCCC4=O)NC3=O

Isomeric SMILES

C1CCC(C1)SC2=CC=CC=C2NC(=O)C3=CC4=C(CCCC4=O)NC3=O

InChI

InChI=1S/C21H22N2O3S/c24-18-10-5-9-16-14(18)12-15(20(25)22-16)21(26)23-17-8-3-4-11-19(17)27-13-6-1-2-7-13/h3-4,8,11-13H,1-2,5-7,9-10H2,(H,22,25)(H,23,26)