1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methylindolin-1-yl)ethanone CAS Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(2-methyl-2,3-dihydroindol-1-yl)-2-[(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 2-[(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1-(2-methylindolin-1-yl)ethanone Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CSC3=NN=C(N3CC=C)C4=CC=CC=C4

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)CSC3=NN=C(N3CC=C)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4OS/c1-3-13-25-21(17-9-5-4-6-10-17)23-24-22(25)28-15-20(27)26-16(2)14-18-11-7-8-12-19(18)26/h3-12,16H,1,13-15H2,2H3