N-[2-[[5-(oxan-2-yl)thiophen-2-yl]methyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide

Systemtic Name: N-[2-[[5-(oxan-2-yl)thiophen-2-yl]methyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide Openeye Name: N-[2-[(5-tetrahydropyran-2-yl-2-thienyl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide CAS Name: N-[2-[[5-(2-oxanyl)-2-thiophenyl]methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyridinecarboxamide IUPAC Name: N-[2-[[5-(oxan-2-yl)thiophen-2-yl]methyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide Traditional Name: N-[2-[(5-tetrahydropyran-2-yl-2-thienyl)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]isonicotinamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)C2=CC=C(S2)CN3CCC4=C(C3)C=C(C=C4)NC(=O)C5=CC=NC=C5

Isomeric SMILES

C1CCOC(C1)C2=CC=C(S2)CN3CCC4=C(C3)C=C(C=C4)NC(=O)C5=CC=NC=C5

InChI

InChI=1S/C25H27N3O2S/c29-25(19-8-11-26-12-9-19)27-21-5-4-18-10-13-28(16-20(18)15-21)17-22-6-7-24(31-22)23-3-1-2-14-30-23/h4-9,11-12,15,23H,1-3,10,13-14,16-17H2,(H,27,29)