3-(2-azanylethyl)-1-(3-azanylpropyl)-7-[bis(phenylmethyl)amino]-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-(2-azanylethyl)-1-(3-azanylpropyl)-7-[bis(phenylmethyl)amino]-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-(2-aminoethyl)-1-(3-aminopropyl)-7-(dibenzylamino)-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-(2-aminoethyl)-1-(3-aminopropyl)-7-[bis(phenylmethyl)amino]-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-(2-aminoethyl)-1-(3-aminopropyl)-7-(dibenzylamino)-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-(2-aminoethyl)-1-(3-aminopropyl)-7-(dibenzylamino)-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C34H37N5O MolecularWeight: 531.69048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC4=C(C=C3)N(C(=O)C(N=C4C5=CC=CC=C5)CCN)CCCN

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=CC4=C(C=C3)N(C(=O)C(N=C4C5=CC=CC=C5)CCN)CCCN

InChI

InChI=1S/C34H37N5O/c35-20-10-22-39-32-18-17-29(38(24-26-11-4-1-5-12-26)25-27-13-6-2-7-14-27)23-30(32)33(28-15-8-3-9-16-28)37-31(19-21-36)34(39)40/h1-9,11-18,23,31H,10,19-22,24-25,35-36H2