3-(3,3-dimethylindol-2-yl)-7-methylsulfanyl-chromen-2-one

Systemtic Name: 3-(3,3-dimethylindol-2-yl)-7-methylsulfanyl-chromen-2-one Openeye Name: 3-(3,3-dimethylindol-2-yl)-7-methylsulfanyl-chromen-2-one CAS Name: 3-(3,3-dimethyl-2-indolyl)-7-(methylthio)-1-benzopyran-2-one IUPAC Name: 3-(3,3-dimethylindol-2-yl)-7-methylsulfanylchromen-2-one Traditional Name: 3-(3,3-dimethylindol-2-yl)-7-(methylthio)coumarin Formula: C20H17NO2S MolecularWeight: 335.41948

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N=C1C3=CC4=C(C=C(C=C4)SC)OC3=O)C

Isomeric SMILES

CC1(C2=CC=CC=C2N=C1C3=CC4=C(C=C(C=C4)SC)OC3=O)C

InChI

InChI=1S/C20H17NO2S/c1-20(2)15-6-4-5-7-16(15)21-18(20)14-10-12-8-9-13(24-3)11-17(12)23-19(14)22/h4-11H,1-3H3