methyl 4-[(6-acetamido-1,3-benzothiazol-2-yl)carbamoyl]benzoate

Systemtic Name: methyl 4-[(6-acetamido-1,3-benzothiazol-2-yl)carbamoyl]benzoate Openeye Name: methyl 4-[(6-acetamido-1,3-benzothiazol-2-yl)carbamoyl]benzoate CAS Name: 4-[[(6-acetamido-1,3-benzothiazol-2-yl)amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(6-acetamido-1,3-benzothiazol-2-yl)carbamoyl]benzoate Traditional Name: 4-[(6-acetamido-1,3-benzothiazol-2-yl)carbamoyl]benzoic acid methyl ester Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C18H15N3O4S/c1-10(22)19-13-7-8-14-15(9-13)26-18(20-14)21-16(23)11-3-5-12(6-4-11)17(24)25-2/h3-9H,1-2H3,(H,19,22)(H,20,21,23)