N-carbamimidoyl-3-(chloromethyl)-N-piperazin-1-yl-benzamide

Systemtic Name: N-carbamimidoyl-3-(chloromethyl)-N-piperazin-1-yl-benzamide Openeye Name: N-carbamimidoyl-3-(chloromethyl)-N-piperazin-1-yl-benzamide CAS Name: N-carbamimidoyl-3-(chloromethyl)-N-(1-piperazinyl)benzamide IUPAC Name: N-carbamimidoyl-3-(chloromethyl)-N-piperazin-1-ylbenzamide Traditional Name: N-amidino-3-(chloromethyl)-N-piperazino-benzamide Formula: C13H18ClN5O MolecularWeight: 295.76792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)N(C(=O)C2=CC(=CC=C2)CCl)C(=N)N

Isomeric SMILES

C1CN(CCN1)N(C(=O)C2=CC(=CC=C2)CCl)C(=N)N

InChI

InChI=1S/C13H18ClN5O/c14-9-10-2-1-3-11(8-10)12(20)19(13(15)16)18-6-4-17-5-7-18/h1-3,8,17H,4-7,9H2,(H3,15,16)