N-(2-azanyl-5-thiophen-2-yl-phenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide

Systemtic Name: N-(2-azanyl-5-thiophen-2-yl-phenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide Openeye Name: N-[2-amino-5-(2-thienyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)tetrahydropyran-4-yl]benzamide CAS Name: N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)-4-oxanyl]benzamide IUPAC Name: N-(2-amino-5-thiophen-2-ylphenyl)-4-[4-(2,3-dihydropyridin-2-yl)oxan-4-yl]benzamide Traditional Name: N-[2-amino-5-(2-thienyl)phenyl]-4-[4-(2,3-dihydropyridin-2-yl)tetrahydropyran-4-yl]benzamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2CC=CC=N2)C3=CC=C(C=C3)C(=O)NC4=C(C=CC(=C4)C5=CC=CS5)N

Isomeric SMILES

C1COCCC1(C2CC=CC=N2)C3=CC=C(C=C3)C(=O)NC4=C(C=CC(=C4)C5=CC=CS5)N

InChI

InChI=1S/C27H27N3O2S/c28-22-11-8-20(24-4-3-17-33-24)18-23(22)30-26(31)19-6-9-21(10-7-19)27(12-15-32-16-13-27)25-5-1-2-14-29-25/h1-4,6-11,14,17-18,25H,5,12-13,15-16,28H2,(H,30,31)