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

Systemtic Name: N-[3-(cyclohexylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide Openeye Name: N-[3-(cyclohexylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]pyridine-4-carboxamide CAS Name: N-[3-[(cyclohexylamino)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-pyridinecarboxamide IUPAC Name: N-[3-(cyclohexylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]pyridine-4-carboxamide Traditional Name: N-[3-(cyclohexylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]isonicotinamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CC=NC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=C(SC3=C2CCCC3)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C21H25N3O2S/c25-19(14-10-12-22-13-11-14)24-21-18(16-8-4-5-9-17(16)27-21)20(26)23-15-6-2-1-3-7-15/h10-13,15H,1-9H2,(H,23,26)(H,24,25)