3-[3-[1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-[1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-(2-indolin-1-yl-1-methyl-2-oxo-ethyl)sulfanyl-5-(2-thienyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-[[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]thio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]sulfanyl-5-thiophen-2-yl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-[(2-indolin-1-yl-2-keto-1-methyl-ethyl)thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]propionamide Formula: C20H21N5O2S2 MolecularWeight: 427.54304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3CCC(=O)N)C4=CC=CS4

Isomeric SMILES

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=C(N3CCC(=O)N)C4=CC=CS4

InChI

InChI=1S/C20H21N5O2S2/c1-13(19(27)24-10-8-14-5-2-3-6-15(14)24)29-20-23-22-18(16-7-4-12-28-16)25(20)11-9-17(21)26/h2-7,12-13H,8-11H2,1H3,(H2,21,26)