N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-3-(4-oxidanylidenecinnolin-1-yl)propanamide

Systemtic Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-3-(4-oxidanylidenecinnolin-1-yl)propanamide Openeye Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-3-(4-oxocinnolin-1-yl)propanamide CAS Name: N-[4-[5-(acetamidomethyl)-2-thiophenyl]-2-thiazolyl]-3-(4-oxo-1-cinnolinyl)propanamide IUPAC Name: N-[4-[5-(acetamidomethyl)thiophen-2-yl]-1,3-thiazol-2-yl]-3-(4-oxocinnolin-1-yl)propanamide Traditional Name: N-[4-[5-(acetamidomethyl)-2-thienyl]thiazol-2-yl]-3-(4-ketocinnolin-1-yl)propionamide Formula: C21H19N5O3S2 MolecularWeight: 453.53726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(S1)C2=CSC(=N2)NC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

CC(=O)NCC1=CC=C(S1)C2=CSC(=N2)NC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C21H19N5O3S2/c1-13(27)22-10-14-6-7-19(31-14)16-12-30-21(24-16)25-20(29)8-9-26-17-5-3-2-4-15(17)18(28)11-23-26/h2-7,11-12H,8-10H2,1H3,(H,22,27)(H,24,25,29)