2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2-methyl-1H-indol-3-yl)-1-propanone IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)propan-1-one Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-1-(2-methyl-1H-indol-3-yl)propan-1-one Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NNC(=N3)N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(C)SC3=NNC(=N3)N

InChI

InChI=1S/C14H15N5OS/c1-7-11(9-5-3-4-6-10(9)16-7)12(20)8(2)21-14-17-13(15)18-19-14/h3-6,8,16H,1-2H3,(H3,15,17,18,19)