methyl 2-(6-acetamido-2-naphthalen-1-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(6-acetamido-2-naphthalen-1-ylcarbonylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-[6-acetamido-2-(naphthalene-1-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-acetamido-2-[1-naphthalenyl(oxo)methyl]imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-acetamido-2-(naphthalene-1-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-acetamido-2-(1-naphthoylimino)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC4=CC=CC=C43)S2)CC(=O)OC

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC4=CC=CC=C43)S2)CC(=O)OC

InChI

InChI=1S/C23H19N3O4S/c1-14(27)24-16-10-11-19-20(12-16)31-23(26(19)13-21(28)30-2)25-22(29)18-9-5-7-15-6-3-4-8-17(15)18/h3-12H,13H2,1-2H3,(H,24,27)