N-[1-(1H-imidazol-5-ylmethyl)-4-naphthalen-1-ylcarbonyl-5H-1,4-benzodiazepin-8-yl]oxolane-3-carboxamide

Systemtic Name: N-[1-(1H-imidazol-5-ylmethyl)-4-naphthalen-1-ylcarbonyl-5H-1,4-benzodiazepin-8-yl]oxolane-3-carboxamide Openeye Name: N-[1-(1H-imidazol-5-ylmethyl)-4-(naphthalene-1-carbonyl)-5H-1,4-benzodiazepin-8-yl]tetrahydrofuran-3-carboxamide CAS Name: N-[1-(1H-imidazol-5-ylmethyl)-4-[1-naphthalenyl(oxo)methyl]-5H-1,4-benzodiazepin-8-yl]-3-oxolanecarboxamide IUPAC Name: N-[1-(1H-imidazol-5-ylmethyl)-4-(naphthalene-1-carbonyl)-5H-1,4-benzodiazepin-8-yl]oxolane-3-carboxamide Traditional Name: N-[1-(1H-imidazol-5-ylmethyl)-4-(1-naphthoyl)-5H-1,4-benzodiazepin-8-yl]tetrahydrofuran-3-carboxamide Formula: C29H27N5O3 MolecularWeight: 493.55638

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C(=O)NC2=CC3=C(CN(C=CN3CC4=CN=CN4)C(=O)C5=CC=CC6=CC=CC=C65)C=C2

Isomeric SMILES

C1COCC1C(=O)NC2=CC3=C(CN(C=CN3CC4=CN=CN4)C(=O)C5=CC=CC6=CC=CC=C65)C=C2

InChI

InChI=1S/C29H27N5O3/c35-28(22-10-13-37-18-22)32-23-9-8-21-16-34(12-11-33(27(21)14-23)17-24-15-30-19-31-24)29(36)26-7-3-5-20-4-1-2-6-25(20)26/h1-9,11-12,14-15,19,22H,10,13,16-18H2,(H,30,31)(H,32,35)