4-[[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one

Systemtic Name: 4-[[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]sulfanylmethyl]-6,7-dimethyl-chromen-2-one Openeye Name: 4-[(2-indolin-1-yl-2-oxo-ethyl)sulfanylmethyl]-6,7-dimethyl-chromen-2-one CAS Name: 4-[[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]thio]methyl]-6,7-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanylmethyl]-6,7-dimethylchromen-2-one Traditional Name: 4-[[(2-indolin-1-yl-2-keto-ethyl)thio]methyl]-6,7-dimethyl-coumarin Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)N3CCC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSCC(=O)N3CCC4=CC=CC=C43)C

InChI

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