N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-3-chloro-benzothiophene-2-carboxamide Formula: C17H19ClN2O2S MolecularWeight: 350.86296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H19ClN2O2S/c18-15-12-7-3-4-8-13(12)23-16(15)17(22)19-11-14(21)20-9-5-1-2-6-10-20/h3-4,7-8H,1-2,5-6,9-11H2,(H,19,22)