N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-2-phenylsulfanyl-pyridine-3-carbohydrazide

Systemtic Name: N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonyl]-2-phenylsulfanyl-pyridine-3-carbohydrazide Openeye Name: N'-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)-2-phenylsulfanyl-pyridine-3-carbohydrazide CAS Name: N'-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]-2-(phenylthio)-3-pyridinecarbohydrazide IUPAC Name: N'-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)-2-phenylsulfanylpyridine-3-carbohydrazide Traditional Name: N'-(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)-2-(phenylthio)nicotinohydrazide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S2/c1-14-9-10-18-15(12-14)13-19(29-18)21(27)25-24-20(26)17-8-5-11-23-22(17)28-16-6-3-2-4-7-16/h2-8,11,13-14H,9-10,12H2,1H3,(H,24,26)(H,25,27)