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

Systemtic Name: 5-[(4-methylpiperazin-1-yl)methyl]-N-[(3S)-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide Openeye Name: 5-[(4-methylpiperazin-1-yl)methyl]-N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]furan-2-carboxamide CAS Name: 5-[(4-methyl-1-piperazinyl)methyl]-N-[(3S)-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl]-2-furancarboxamide IUPAC Name: 5-[(4-methylpiperazin-1-yl)methyl]-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-[(4-methylpiperazino)methyl]-2-furamide Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C(O2)C(=O)NC3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C(O2)C(=O)N[C@@H]3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C26H27N5O3/c1-30-13-15-31(16-14-30)17-19-11-12-22(34-19)25(32)29-24-26(33)27-21-10-6-5-9-20(21)23(28-24)18-7-3-2-4-8-18/h2-12,24H,13-17H2,1H3,(H,27,33)(H,29,32)/t24-/m1/s1