3-azanyl-N-[3-(6-carbamimidoylnaphthalen-2-yl)prop-2-ynyl]benzamide

Systemtic Name: 3-azanyl-N-[3-(6-carbamimidoylnaphthalen-2-yl)prop-2-ynyl]benzamide Openeye Name: 3-amino-N-[3-(6-carbamimidoyl-2-naphthyl)prop-2-ynyl]benzamide CAS Name: 3-amino-N-[3-(6-carbamimidoyl-2-naphthalenyl)prop-2-ynyl]benzamide IUPAC Name: 3-amino-N-[3-(6-carbamimidoylnaphthalen-2-yl)prop-2-ynyl]benzamide Traditional Name: N-[3-(6-amidino-2-naphthyl)prop-2-ynyl]-3-amino-benzamide Formula: C21H18N4O MolecularWeight: 342.39382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)C(=O)NCC#CC2=CC3=C(C=C2)C=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)N)C(=O)NCC#CC2=CC3=C(C=C2)C=C(C=C3)C(=N)N

InChI

InChI=1S/C21H18N4O/c22-19-5-1-4-18(13-19)21(26)25-10-2-3-14-6-7-16-12-17(20(23)24)9-8-15(16)11-14/h1,4-9,11-13H,10,22H2,(H3,23,24)(H,25,26)