3-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]-6-nitro-chromen-2-one

Systemtic Name: 3-[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]-6-nitro-chromen-2-one Openeye Name: 3-[2-(4-methylanilino)thiazol-4-yl]-6-nitro-chromen-2-one CAS Name: 3-[2-(4-methylanilino)-4-thiazolyl]-6-nitro-1-benzopyran-2-one IUPAC Name: 3-[2-(4-methylanilino)-1,3-thiazol-4-yl]-6-nitrochromen-2-one Traditional Name: 6-nitro-3-[2-(p-toluidino)thiazol-4-yl]coumarin Formula: C19H13N3O4S MolecularWeight: 379.38922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C19H13N3O4S/c1-11-2-4-13(5-3-11)20-19-21-16(10-27-19)15-9-12-8-14(22(24)25)6-7-17(12)26-18(15)23/h2-10H,1H3,(H,20,21)