1-(7-ethyl-1H-indol-3-yl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanone

Systemtic Name: 1-(7-ethyl-1H-indol-3-yl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanone Openeye Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-(7-ethyl-1H-indol-3-yl)-2-phenyl-ethanone CAS Name: 1-(7-ethyl-1H-indol-3-yl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-2-phenylethanone IUPAC Name: 1-(7-ethyl-1H-indol-3-yl)-2-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylethanone Traditional Name: 2-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-1-(7-ethyl-1H-indol-3-yl)-2-phenyl-ethanone Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)C(C3=CC=CC=C3)SC4=NN=C(N4CC=C)C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)C(C3=CC=CC=C3)SC4=NN=C(N4CC=C)C

InChI

InChI=1S/C24H24N4OS/c1-4-14-28-16(3)26-27-24(28)30-23(18-10-7-6-8-11-18)22(29)20-15-25-21-17(5-2)12-9-13-19(20)21/h4,6-13,15,23,25H,1,5,14H2,2-3H3