2-azanyl-2-methyl-N-[(7R)-8-oxidanylidene-9-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-6,7-dihydro-5H-pyrido[2,3-b]azepin-7-yl]propanamide

Systemtic Name: 2-azanyl-2-methyl-N-[(7R)-8-oxidanylidene-9-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-6,7-dihydro-5H-pyrido[2,3-b]azepin-7-yl]propanamide Openeye Name: 2-amino-2-methyl-N-[(7R)-8-oxo-9-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-6,7-dihydro-5H-pyrido[2,3-b]azepin-7-yl]propanamide CAS Name: 2-amino-2-methyl-N-[(7R)-8-oxo-9-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-6,7-dihydro-5H-pyrido[2,3-b]azepin-7-yl]propanamide IUPAC Name: 2-amino-2-methyl-N-[(7R)-8-oxo-9-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-6,7-dihydro-5H-pyrido[2,3-b]azepin-7-yl]propanamide Traditional Name: 2-amino-N-[(7R)-8-keto-9-[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]-6,7-dihydro-5H-pyrid[2,3-b]azepin-7-yl]-2-methyl-propionamide Formula: C27H28N8O2 MolecularWeight: 496.56362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1CCC2=C(N=CC=C2)N(C1=O)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)N

Isomeric SMILES

CC(C)(C(=O)N[C@@H]1CCC2=C(N=CC=C2)N(C1=O)CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5)N

InChI

InChI=1S/C27H28N8O2/c1-27(2,28)26(37)30-22-14-13-19-6-5-15-29-24(19)35(25(22)36)16-17-9-11-18(12-10-17)20-7-3-4-8-21(20)23-31-33-34-32-23/h3-12,15,22H,13-14,16,28H2,1-2H3,(H,30,37)(H,31,32,33,34)/t22-/m1/s1