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

Systemtic Name: methyl 2-[(4-aminophenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(4-aminobenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(4-aminophenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-aminobenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(4-aminobenzoyl)amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C16H13N3O3S MolecularWeight: 327.35772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)N

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C16H13N3O3S/c1-22-15(21)10-4-7-12-13(8-10)23-16(18-12)19-14(20)9-2-5-11(17)6-3-9/h2-8H,17H2,1H3,(H,18,19,20)