3-[2-[(2-aminocarbonyl-3-azanyl-3-oxidanylidene-prop-1-enyl)amino]-1,3-thiazol-4-yl]-N-oxidanyl-benzeneamine oxide hydrochloride

Systemtic Name: 3-[2-[(2-aminocarbonyl-3-azanyl-3-oxidanylidene-prop-1-enyl)amino]-1,3-thiazol-4-yl]-N-oxidanyl-benzeneamine oxide hydrochloride Openeye Name: 3-[2-[(3-amino-2-carbamoyl-3-oxo-prop-1-enyl)amino]thiazol-4-yl]-N-hydroxy-benzeneamine oxide hydrochloride CAS Name: 3-[2-[(3-amino-2-carbamoyl-3-oxoprop-1-enyl)amino]-4-thiazolyl]-N-hydroxybenzeneamine oxide hydrochloride IUPAC Name: 3-[2-[(3-amino-2-carbamoyl-3-oxoprop-1-enyl)amino]-1,3-thiazol-4-yl]-N-hydroxybenzeneamine oxide hydrochloride Traditional Name: 3-[2-[(3-amino-2-carbamoyl-3-keto-prop-1-enyl)amino]thiazol-4-yl]-N-hydroxy-benzeneamine oxide hydrochloride Formula: C13H14ClN5O4S MolecularWeight: 371.79936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[NH+](O)[O-])C2=CSC(=N2)NC=C(C(=O)N)C(=O)N.Cl

Isomeric SMILES

C1=CC(=CC(=C1)[NH+](O)[O-])C2=CSC(=N2)NC=C(C(=O)N)C(=O)N.Cl

InChI

InChI=1S/C13H13N5O4S.ClH/c14-11(19)9(12(15)20)5-16-13-17-10(6-23-13)7-2-1-3-8(4-7)18(21)22;/h1-6,18,21H,(H2,14,19)(H2,15,20)(H,16,17);1H