methyl 4-[[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl]amino]-3-methyl-benzoate

Systemtic Name: methyl 4-[[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl]amino]-3-methyl-benzoate Openeye Name: methyl 4-[[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl]amino]-3-methyl-benzoate CAS Name: 4-[[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl]amino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl]amino]-3-methylbenzoate Traditional Name: 4-[[2-keto-2-(piazthiol-4-ylamino)ethyl]amino]-3-methyl-benzoic acid methyl ester Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NCC(=O)NC2=CC=CC3=NSN=C32

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NCC(=O)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C17H16N4O3S/c1-10-8-11(17(23)24-2)6-7-12(10)18-9-15(22)19-13-4-3-5-14-16(13)21-25-20-14/h3-8,18H,9H2,1-2H3,(H,19,22)