1-(2,3-dihydro-1H-inden-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: 1-indan-5-yl-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one CAS Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: 1-(2,3-dihydro-1H-inden-5-yl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: 1-indan-5-yl-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]propan-1-one Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)SC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)C1=CC2=C(CCC2)C=C1)SC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C20H19N3OS/c1-14(19(24)17-11-10-15-6-5-7-16(15)12-17)25-20-22-21-13-23(20)18-8-3-2-4-9-18/h2-4,8-14H,5-7H2,1H3