(2R)-2-[[(5E)-5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: (2R)-2-[[(5E)-5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: (2R)-2-[[(5E)-5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-2-[[(5E)-5-(2-indolylidene)-4-phenyl-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: (2R)-2-[[(5E)-5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: (2R)-2-[[(5E)-5-indol-2-ylidene-4-phenyl-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)SC1=NNC(=C2C=C3C=CC=CC3=N2)N1C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)N)SC1=NN/C(=C/2\C=C3C=CC=CC3=N2)/N1C4=CC=CC=C4

InChI

InChI=1S/C19H17N5OS/c1-12(17(20)25)26-19-23-22-18(24(19)14-8-3-2-4-9-14)16-11-13-7-5-6-10-15(13)21-16/h2-12,22H,1H3,(H2,20,25)/b18-16-/t12-/m1/s1