2-[[5-(2,3-dimethyl-1H-indol-5-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-(2,3-dimethyl-1H-indol-5-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(2,3-dimethyl-1H-indol-5-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(2,3-dimethyl-1H-indol-5-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-(2,3-dimethyl-1H-indol-5-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(2,3-dimethyl-1H-indol-5-yl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H19N5OS MolecularWeight: 341.43066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3CC=C)SCC(=O)N)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3CC=C)SCC(=O)N)C

InChI

InChI=1S/C17H19N5OS/c1-4-7-22-16(20-21-17(22)24-9-15(18)23)12-5-6-14-13(8-12)10(2)11(3)19-14/h4-6,8,19H,1,7,9H2,2-3H3,(H2,18,23)