methyl 1-[2-oxidanylidene-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]indole-3-carboxylate CAS Name: 1-[2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]indole-3-carboxylate Traditional Name: 1-[2-keto-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]indole-3-carboxylic acid methyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=NC4=C(S3)CCCC4

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)NC3=NC4=C(S3)CCCC4

InChI

InChI=1S/C19H19N3O3S/c1-25-18(24)13-10-22(15-8-4-2-6-12(13)15)11-17(23)21-19-20-14-7-3-5-9-16(14)26-19/h2,4,6,8,10H,3,5,7,9,11H2,1H3,(H,20,21,23)