ethyl 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=CC(=C3C)C(=O)OCC)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C(=CC(=C3C)C(=O)OCC)C

InChI

InChI=1S/C20H23N3O3S/c1-5-14-7-8-16-17(10-14)27-20(21-16)22-18(24)11-23-12(3)9-15(13(23)4)19(25)26-6-2/h7-10H,5-6,11H2,1-4H3,(H,21,22,24)