3-[3-cyclopropyl-5-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-cyclopropyl-5-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-cyclopropyl-5-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-cyclopropyl-5-[[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]thio]-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-cyclopropyl-5-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-cyclopropyl-5-[[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl]thio]-1,2,4-triazol-4-yl]propionamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NN=C(N3CCC(=O)N)C4CC4

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)CSC3=NN=C(N3CCC(=O)N)C4CC4

InChI

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