3-(1-benzothiophen-3-yl)-N-(cyanomethyl)-2-formamido-propanamide

Systemtic Name: 3-(1-benzothiophen-3-yl)-N-(cyanomethyl)-2-formamido-propanamide Openeye Name: 3-(benzothiophen-3-yl)-N-(cyanomethyl)-2-formamido-propanamide CAS Name: 3-(1-benzothiophen-3-yl)-N-(cyanomethyl)-2-formamidopropanamide IUPAC Name: 3-(1-benzothiophen-3-yl)-N-(cyanomethyl)-2-formamidopropanamide Traditional Name: 3-(benzothiophen-3-yl)-N-(cyanomethyl)-2-formamido-propionamide Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O2S/c15-5-6-16-14(19)12(17-9-18)7-10-8-20-13-4-2-1-3-11(10)13/h1-4,8-9,12H,6-7H2,(H,16,19)(H,17,18)