1-[2,4-bis(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepin-3-yl]propan-1-ol

Systemtic Name: 1-[2,4-bis(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepin-3-yl]propan-1-ol Openeye Name: 1-[2,4-bis(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepin-3-yl]propan-1-ol CAS Name: 1-[2,4-bis(4-methyl-1-piperazinyl)-3H-1,5-benzodiazepin-3-yl]-1-propanol IUPAC Name: 1-[2,4-bis(4-methylpiperazin-1-yl)-3H-1,5-benzodiazepin-3-yl]propan-1-ol Traditional Name: 1-[2,4-bis(4-methylpiperazino)-3H-1,5-benzodiazepin-3-yl]propan-1-ol Formula: C22H34N6O MolecularWeight: 398.54496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1C(=NC2=CC=CC=C2N=C1N3CCN(CC3)C)N4CCN(CC4)C)O

Isomeric SMILES

CCC(C1C(=NC2=CC=CC=C2N=C1N3CCN(CC3)C)N4CCN(CC4)C)O

InChI

InChI=1S/C22H34N6O/c1-4-19(29)20-21(27-13-9-25(2)10-14-27)23-17-7-5-6-8-18(17)24-22(20)28-15-11-26(3)12-16-28/h5-8,19-20,29H,4,9-16H2,1-3H3