2-[(4-aminophenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: 2-[(4-aminophenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: 2-[(4-aminobenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(4-aminophenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylate IUPAC Name: 2-[(4-aminobenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(4-aminobenzoyl)amino]-1,3-benzothiazole-6-carboxylate Formula: C15H10N3O3S- MolecularWeight: 312.3232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)[O-])N

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)[O-])N

InChI

InChI=1S/C15H11N3O3S/c16-10-4-1-8(2-5-10)13(19)18-15-17-11-6-3-9(14(20)21)7-12(11)22-15/h1-7H,16H2,(H,20,21)(H,17,18,19)/p-1