N-[6-chloranyl-5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-7-yl]morpholine-4-carboxamide; 1-methylpiperazine

Systemtic Name: N-[6-chloranyl-5-(2-fluorophenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-7-yl]morpholine-4-carboxamide; 1-methylpiperazine Openeye Name: N-[6-chloro-5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]morpholine-4-carboxamide; 1-methylpiperazine CAS Name: N-[6-chloro-5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]-4-morpholinecarboxamide; 1-methylpiperazine IUPAC Name: N-[6-chloro-5-(2-fluorophenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-7-yl]morpholine-4-carboxamide; 1-methylpiperazine Traditional Name: N-[6-chloro-5-(2-fluorophenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-7-yl]morpholine-4-carboxamide; 1-methylpiperazine Formula: C26H32ClFN6O3 MolecularWeight: 531.022083

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCNCC1.CN1C(=O)CN=C(C2=C1C=CC(=C2Cl)NC(=O)N3CCOCC3)C4=CC=CC=C4F

Isomeric SMILES

CN1CCNCC1.CN1C(=O)CN=C(C2=C1C=CC(=C2Cl)NC(=O)N3CCOCC3)C4=CC=CC=C4F

InChI

InChI=1S/C21H20ClFN4O3.C5H12N2/c1-26-16-7-6-15(25-21(29)27-8-10-30-11-9-27)19(22)18(16)20(24-12-17(26)28)13-4-2-3-5-14(13)23;1-7-4-2-6-3-5-7/h2-7H,8-12H2,1H3,(H,25,29);6H,2-5H2,1H3