N-[4-(aminomethyl)phenyl]-4-[6-carbamimidoyl-4-(pyrimidin-2-ylamino)naphthalen-2-yl]benzamide

Systemtic Name: N-[4-(aminomethyl)phenyl]-4-[6-carbamimidoyl-4-(pyrimidin-2-ylamino)naphthalen-2-yl]benzamide Openeye Name: N-[4-(aminomethyl)phenyl]-4-[6-carbamimidoyl-4-(pyrimidin-2-ylamino)-2-naphthyl]benzamide CAS Name: N-[4-(aminomethyl)phenyl]-4-[6-carbamimidoyl-4-(2-pyrimidinylamino)-2-naphthalenyl]benzamide IUPAC Name: N-[4-(aminomethyl)phenyl]-4-[6-carbamimidoyl-4-(pyrimidin-2-ylamino)naphthalen-2-yl]benzamide Traditional Name: 4-[6-amidino-4-(2-pyrimidylamino)-2-naphthyl]-N-[4-(aminomethyl)phenyl]benzamide Formula: C29H25N7O MolecularWeight: 487.5551

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC2=C3C=C(C=CC3=CC(=C2)C4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)CN)C(=N)N

Isomeric SMILES

C1=CN=C(N=C1)NC2=C3C=C(C=CC3=CC(=C2)C4=CC=C(C=C4)C(=O)NC5=CC=C(C=C5)CN)C(=N)N

InChI

InChI=1S/C29H25N7O/c30-17-18-2-10-24(11-3-18)35-28(37)20-6-4-19(5-7-20)23-14-21-8-9-22(27(31)32)15-25(21)26(16-23)36-29-33-12-1-13-34-29/h1-16H,17,30H2,(H3,31,32)(H,35,37)(H,33,34,36)