4-[[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylmethyl]-7-ethyl-chromen-2-one

Systemtic Name: 4-[[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylmethyl]-7-ethyl-chromen-2-one Openeye Name: 7-ethyl-4-[(2-indolin-1-yl-2-oxo-ethyl)sulfanylmethyl]chromen-2-one CAS Name: 4-[[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanylmethyl]-7-ethylchromen-2-one Traditional Name: 7-ethyl-4-[[(2-indolin-1-yl-2-keto-ethyl)thio]methyl]coumarin Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSCC(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H21NO3S/c1-2-15-7-8-18-17(12-22(25)26-20(18)11-15)13-27-14-21(24)23-10-9-16-5-3-4-6-19(16)23/h3-8,11-12H,2,9-10,13-14H2,1H3