4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)-N-[(3S,7S)-2-oxidanylidene-7-phenyl-1-(phenylmethyl)azepan-3-yl]piperidine-1-carboxamide

Systemtic Name: 4-(2-oxidanylidene-1,4-dihydroquinazolin-3-yl)-N-[(3S,7S)-2-oxidanylidene-7-phenyl-1-(phenylmethyl)azepan-3-yl]piperidine-1-carboxamide Openeye Name: N-[(3S,7S)-1-benzyl-2-oxo-7-phenyl-azepan-3-yl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide CAS Name: 4-(2-oxo-1,4-dihydroquinazolin-3-yl)-N-[(3S,7S)-2-oxo-7-phenyl-1-(phenylmethyl)-3-azepanyl]-1-piperidinecarboxamide IUPAC Name: N-[(3S,7S)-1-benzyl-2-oxo-7-phenylazepan-3-yl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Traditional Name: N-[(3S,7S)-1-benzyl-2-keto-7-phenyl-azepan-3-yl]-4-(2-keto-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide Formula: C33H37N5O3 MolecularWeight: 551.67858

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C(C1)C2=CC=CC=C2)CC3=CC=CC=C3)NC(=O)N4CCC(CC4)N5CC6=CC=CC=C6NC5=O

Isomeric SMILES

C1C[C@@H](C(=O)N([C@@H](C1)C2=CC=CC=C2)CC3=CC=CC=C3)NC(=O)N4CCC(CC4)N5CC6=CC=CC=C6NC5=O

InChI

InChI=1S/C33H37N5O3/c39-31-29(16-9-17-30(25-12-5-2-6-13-25)38(31)22-24-10-3-1-4-11-24)35-32(40)36-20-18-27(19-21-36)37-23-26-14-7-8-15-28(26)34-33(37)41/h1-8,10-15,27,29-30H,9,16-23H2,(H,34,41)(H,35,40)/t29-,30-/m0/s1