[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid [2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl] ester Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N2O3S/c1-2-14-6-5-7-15-16(12-23-22(14)15)18(25)13-27-21(26)11-10-20-24-17-8-3-4-9-19(17)28-20/h3-9,12,23H,2,10-11,13H2,1H3