3-[4-cyclopropyl-5-[1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-cyclopropyl-5-[1-(2-methyl-1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-[1-methyl-2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-[[1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]thio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-[1-(2-methyl-1H-indol-3-yl)-1-oxopropan-2-yl]sulfanyl-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-[[2-keto-1-methyl-2-(2-methyl-1H-indol-3-yl)ethyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NN=C(N3C4CC4)CCC(=O)N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NN=C(N3C4CC4)CCC(=O)N

InChI

InChI=1S/C20H23N5O2S/c1-11-18(14-5-3-4-6-15(14)22-11)19(27)12(2)28-20-24-23-17(10-9-16(21)26)25(20)13-7-8-13/h3-6,12-13,22H,7-10H2,1-2H3,(H2,21,26)