N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[(1-methylimidazol-2-yl)thio]propionamide Formula: C17H20N4OS2 MolecularWeight: 360.4969

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCSC3=NC=CN3C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCSC3=NC=CN3C

InChI

InChI=1S/C17H20N4OS2/c1-11-3-4-12-13(10-18)16(24-14(12)9-11)20-15(22)5-8-23-17-19-6-7-21(17)2/h6-7,11H,3-5,8-9H2,1-2H3,(H,20,22)