5-(hydroxymethyl)-N-[(3S)-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide

Systemtic Name: 5-(hydroxymethyl)-N-[(3S)-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide Openeye Name: 5-(hydroxymethyl)-N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide CAS Name: 5-(hydroxymethyl)-N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-2-furancarboxamide IUPAC Name: 5-(hydroxymethyl)-N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide Traditional Name: N-[(3S)-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-5-methylol-2-furamide Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)NC3=CC=CC=C32)NC(=O)C4=CC=C(O4)CO

Isomeric SMILES

C1=CC=C(C=C1)C2=N[C@@H](C(=O)NC3=CC=CC=C32)NC(=O)C4=CC=C(O4)CO

InChI

InChI=1S/C21H17N3O4/c25-12-14-10-11-17(28-14)20(26)24-19-21(27)22-16-9-5-4-8-15(16)18(23-19)13-6-2-1-3-7-13/h1-11,19,25H,12H2,(H,22,27)(H,24,26)/t19-/m1/s1