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

Systemtic Name: 2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-phenyl-1H-indol-3-yl)ethanone Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-phenyl-1H-indol-3-yl)ethanone CAS Name: 2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-1-(2-phenyl-1H-indol-3-yl)ethanone IUPAC Name: 2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-1-(2-phenyl-1H-indol-3-yl)ethanone Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-1-(2-phenyl-1H-indol-3-yl)ethanone Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC(=O)C2=C(NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4OS/c1-3-13-26-15(2)24-25-22(26)28-14-19(27)20-17-11-7-8-12-18(17)23-21(20)16-9-5-4-6-10-16/h3-12,23H,1,13-14H2,2H3