3-(1H-indol-3-yl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-(1H-indol-3-yl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]propanamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-3-(1H-indol-3-yl)propanamide CAS Name: 3-(1H-indol-3-yl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]propanamide IUPAC Name: 3-(1H-indol-3-yl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]propanamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-3-(1H-indol-3-yl)propionamide Formula: C20H20N6OS2 MolecularWeight: 424.5424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCC2=CNC3=CC=CC=C32)C4=NNC(=S)N4CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCC2=CNC3=CC=CC=C32)C4=NNC(=S)N4CC=C

InChI

InChI=1S/C20H20N6OS2/c1-3-10-26-18(24-25-20(26)28)17-12(2)22-19(29-17)23-16(27)9-8-13-11-21-15-7-5-4-6-14(13)15/h3-7,11,21H,1,8-10H2,2H3,(H,25,28)(H,22,23,27)