[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 8-azanylnaphthalene-1-carboxylate

Systemtic Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 8-azanylnaphthalene-1-carboxylate Openeye Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl] 8-aminonaphthalene-1-carboxylate CAS Name: 8-amino-1-naphthalenecarboxylic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] 8-aminonaphthalene-1-carboxylate Traditional Name: 8-aminonaphthalene-1-carboxylic acid [2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl] ester Formula: C20H15N3O3S MolecularWeight: 377.4164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)COC(=O)C3=CC=CC4=C3C(=CC=C4)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)COC(=O)C3=CC=CC4=C3C(=CC=C4)N

InChI

InChI=1S/C20H15N3O3S/c21-14-8-4-6-12-5-3-7-13(18(12)14)19(25)26-11-17(24)23-20-22-15-9-1-2-10-16(15)27-20/h1-10H,11,21H2,(H,22,23,24)