3-(1,3-benzodioxol-5-yl)-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]prop-2-enamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]prop-2-enamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]prop-2-enamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(2-methyl-1H-indol-3-yl)thio]ethyl]-2-propenamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]prop-2-enamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[2-[(2-methyl-1H-indol-3-yl)thio]ethyl]acrylamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)SCCNC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)SCCNC(=O)C=CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20N2O3S/c1-14-21(16-4-2-3-5-17(16)23-14)27-11-10-22-20(24)9-7-15-6-8-18-19(12-15)26-13-25-18/h2-9,12,23H,10-11,13H2,1H3,(H,22,24)