3-(4-oxidanylidenecinnolin-1-yl)-N-[(4-propylphenyl)-thiophen-2-yl-methyl]propanamide

Systemtic Name: 3-(4-oxidanylidenecinnolin-1-yl)-N-[(4-propylphenyl)-thiophen-2-yl-methyl]propanamide Openeye Name: 3-(4-oxocinnolin-1-yl)-N-[(4-propylphenyl)-(2-thienyl)methyl]propanamide CAS Name: 3-(4-oxo-1-cinnolinyl)-N-[(4-propylphenyl)-thiophen-2-ylmethyl]propanamide IUPAC Name: 3-(4-oxocinnolin-1-yl)-N-[(4-propylphenyl)-thiophen-2-ylmethyl]propanamide Traditional Name: 3-(4-ketocinnolin-1-yl)-N-[(4-propylphenyl)-(2-thienyl)methyl]propionamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C25H25N3O2S/c1-2-6-18-10-12-19(13-11-18)25(23-9-5-16-31-23)27-24(30)14-15-28-21-8-4-3-7-20(21)22(29)17-26-28/h3-5,7-13,16-17,25H,2,6,14-15H2,1H3,(H,27,30)