5-azanyl-2-[methyl-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]amino]benzamide

Systemtic Name: 5-azanyl-2-[methyl-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]amino]benzamide Openeye Name: 5-amino-2-[2-(4-benzylpiperazin-1-yl)ethyl-methyl-amino]benzamide CAS Name: 5-amino-2-[methyl-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]amino]benzamide IUPAC Name: 5-amino-2-[2-(4-benzylpiperazin-1-yl)ethyl-methylamino]benzamide Traditional Name: 5-amino-2-[2-(4-benzylpiperazino)ethyl-methyl-amino]benzamide Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1CCN(CC1)CC2=CC=CC=C2)C3=C(C=C(C=C3)N)C(=O)N

Isomeric SMILES

CN(CCN1CCN(CC1)CC2=CC=CC=C2)C3=C(C=C(C=C3)N)C(=O)N

InChI

InChI=1S/C21H29N5O/c1-24(20-8-7-18(22)15-19(20)21(23)27)9-10-25-11-13-26(14-12-25)16-17-5-3-2-4-6-17/h2-8,15H,9-14,16,22H2,1H3,(H2,23,27)