3-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]-1H-indole-2-carboxylic acid Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C(=O)O)CC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H13N3O3S/c22-15(21-18-20-13-7-3-4-8-14(13)25-18)9-11-10-5-1-2-6-12(10)19-16(11)17(23)24/h1-8,19H,9H2,(H,23,24)(H,20,21,22)