cyanomethyl N-[3-(1-benzothiophen-3-yl)-1-(2-cyanoethylamino)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: cyanomethyl N-[3-(1-benzothiophen-3-yl)-1-(2-cyanoethylamino)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: cyanomethyl N-[1-(benzothiophen-3-ylmethyl)-2-(2-cyanoethylamino)-2-oxo-ethyl]carbamate CAS Name: N-[3-(1-benzothiophen-3-yl)-1-(2-cyanoethylamino)-1-oxopropan-2-yl]carbamic acid cyanomethyl ester IUPAC Name: cyanomethyl N-[3-(1-benzothiophen-3-yl)-1-(2-cyanoethylamino)-1-oxopropan-2-yl]carbamate Traditional Name: N-[1-(benzothiophen-3-ylmethyl)-2-(2-cyanoethylamino)-2-keto-ethyl]carbamic acid cyanomethyl ester Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)CC(C(=O)NCCC#N)NC(=O)OCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)CC(C(=O)NCCC#N)NC(=O)OCC#N

InChI

InChI=1S/C17H16N4O3S/c18-6-3-8-20-16(22)14(21-17(23)24-9-7-19)10-12-11-25-15-5-2-1-4-13(12)15/h1-2,4-5,11,14H,3,8-10H2,(H,20,22)(H,21,23)