1-piperidin-1-yl-N-(2-thiophen-3-ylethyl)isoquinoline-4-carboxamide

Systemtic Name: 1-piperidin-1-yl-N-(2-thiophen-3-ylethyl)isoquinoline-4-carboxamide Openeye Name: 1-(1-piperidyl)-N-[2-(3-thienyl)ethyl]isoquinoline-4-carboxamide CAS Name: 1-(1-piperidinyl)-N-[2-(3-thiophenyl)ethyl]-4-isoquinolinecarboxamide IUPAC Name: 1-piperidin-1-yl-N-(2-thiophen-3-ylethyl)isoquinoline-4-carboxamide Traditional Name: 1-piperidino-N-[2-(3-thienyl)ethyl]isoquinoline-4-carboxamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)NCCC4=CSC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C(=O)NCCC4=CSC=C4

InChI

InChI=1S/C21H23N3OS/c25-21(22-10-8-16-9-13-26-15-16)19-14-23-20(24-11-4-1-5-12-24)18-7-3-2-6-17(18)19/h2-3,6-7,9,13-15H,1,4-5,8,10-12H2,(H,22,25)