1-(1H-indol-3-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(1H-indol-3-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-one Openeye Name: 1-(1H-indol-3-yl)-2-(1-phenyltetrazol-5-yl)sulfanyl-propan-1-one CAS Name: 1-(1H-indol-3-yl)-2-[(1-phenyl-5-tetrazolyl)thio]-1-propanone IUPAC Name: 1-(1H-indol-3-yl)-2-(1-phenyltetrazol-5-yl)sulfanylpropan-1-one Traditional Name: 1-(1H-indol-3-yl)-2-[(1-phenyltetrazol-5-yl)thio]propan-1-one Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H15N5OS/c1-12(17(24)15-11-19-16-10-6-5-9-14(15)16)25-18-20-21-22-23(18)13-7-3-2-4-8-13/h2-12,19H,1H3