methyl (2Z)-2-[(7-chloranyl-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-5-(4-methylpiperazin-1-yl)pentanoate

Systemtic Name: methyl (2Z)-2-[(7-chloranyl-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-5-(4-methylpiperazin-1-yl)pentanoate Openeye Name: methyl (2Z)-2-[(7-chloro-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]-5-(4-methylpiperazin-1-yl)pentanoate CAS Name: (2Z)-2-[(7-chloro-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-5-(4-methyl-1-piperazinyl)pentanoic acid methyl ester IUPAC Name: methyl (2Z)-2-[(7-chloro-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazinylidene]-5-(4-methylpiperazin-1-yl)pentanoate Traditional Name: (2Z)-2-[(7-chloro-3-methyl-5-phenyl-3H-1,4-benzodiazepin-2-yl)hydrazono]-5-(4-methylpiperazino)valeric acid methyl ester Formula: C27H33ClN6O2 MolecularWeight: 509.04292

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)NN=C(CCCN4CCN(CC4)C)C(=O)OC

Isomeric SMILES

CC1C(=NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)N/N=C(/CCCN4CCN(CC4)C)\C(=O)OC

InChI

InChI=1S/C27H33ClN6O2/c1-19-26(32-31-24(27(35)36-3)10-7-13-34-16-14-33(2)15-17-34)30-23-12-11-21(28)18-22(23)25(29-19)20-8-5-4-6-9-20/h4-6,8-9,11-12,18-19H,7,10,13-17H2,1-3H3,(H,30,32)/b31-24-