1-chloranyl-N-(2-thiophen-2-ylethyl)isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-(2-thiophen-2-ylethyl)isoquinoline-3-carboxamide Openeye Name: 1-chloro-N-[2-(2-thienyl)ethyl]isoquinoline-3-carboxamide CAS Name: 1-chloro-N-(2-thiophen-2-ylethyl)-3-isoquinolinecarboxamide IUPAC Name: 1-chloro-N-(2-thiophen-2-ylethyl)isoquinoline-3-carboxamide Traditional Name: 1-chloro-N-[2-(2-thienyl)ethyl]isoquinoline-3-carboxamide Formula: C16H13ClN2OS MolecularWeight: 316.80522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N=C2Cl)C(=O)NCCC3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N=C2Cl)C(=O)NCCC3=CC=CS3

InChI

InChI=1S/C16H13ClN2OS/c17-15-13-6-2-1-4-11(13)10-14(19-15)16(20)18-8-7-12-5-3-9-21-12/h1-6,9-10H,7-8H2,(H,18,20)