3-[(4-ethylphenyl)amino]-4-(3-oxidanylidene-4H-1,4-benzothiazin-7-yl)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(4-ethylphenyl)amino]-4-(3-oxidanylidene-4H-1,4-benzothiazin-7-yl)cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-ethylanilino)-4-(3-oxo-4H-1,4-benzothiazin-7-yl)cyclobut-3-ene-1,2-dione CAS Name: 3-(4-ethylanilino)-4-(3-oxo-4H-1,4-benzothiazin-7-yl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-ethylanilino)-4-(3-oxo-4H-1,4-benzothiazin-7-yl)cyclobut-3-ene-1,2-dione Traditional Name: 3-(4-ethylanilino)-4-(3-keto-4H-1,4-benzothiazin-7-yl)cyclobut-3-ene-1,2-quinone Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C(=O)C2=O)C3=CC4=C(C=C3)NC(=O)CS4

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=O)C2=O)C3=CC4=C(C=C3)NC(=O)CS4

InChI

InChI=1S/C20H16N2O3S/c1-2-11-3-6-13(7-4-11)21-18-17(19(24)20(18)25)12-5-8-14-15(9-12)26-10-16(23)22-14/h3-9,21H,2,10H2,1H3,(H,22,23)