N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide

Systemtic Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide Openeye Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]pyridine-4-carboxamide CAS Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-pyridinecarboxamide IUPAC Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide Traditional Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]isonicotinamide Formula: C18H19N3OS MolecularWeight: 325.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=NC=C3

Isomeric SMILES

CCC[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C18H19N3OS/c1-2-3-12-4-5-14-15(11-19)18(23-16(14)10-12)21-17(22)13-6-8-20-9-7-13/h6-9,12H,2-5,10H2,1H3,(H,21,22)/t12-/m0/s1