2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)ethanone

Systemtic Name: 2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)ethanone Openeye Name: 2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)ethanone CAS Name: 2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-1-(1H-indol-3-yl)ethanone IUPAC Name: 2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-1-(1H-indol-3-yl)ethanone Traditional Name: 2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-1-(1H-indol-3-yl)ethanone Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(=O)C2=CNC3=CC=CC=C32)C4CCCCC4

Isomeric SMILES

C=CCN1C(=NN=C1SCC(=O)C2=CNC3=CC=CC=C32)C4CCCCC4

InChI

InChI=1S/C21H24N4OS/c1-2-12-25-20(15-8-4-3-5-9-15)23-24-21(25)27-14-19(26)17-13-22-18-11-7-6-10-16(17)18/h2,6-7,10-11,13,15,22H,1,3-5,8-9,12,14H2