N-[(1R)-2-[[4-(aminomethyl)phenyl]methylamino]-2-oxidanylidene-1-phenyl-ethyl]-3-carbamimidoyl-benzamide

Systemtic Name: N-[(1R)-2-[[4-(aminomethyl)phenyl]methylamino]-2-oxidanylidene-1-phenyl-ethyl]-3-carbamimidoyl-benzamide Openeye Name: N-[(1R)-2-[[4-(aminomethyl)phenyl]methylamino]-2-oxo-1-phenyl-ethyl]-3-carbamimidoyl-benzamide CAS Name: N-[(1R)-2-[[4-(aminomethyl)phenyl]methylamino]-2-oxo-1-phenylethyl]-3-carbamimidoylbenzamide IUPAC Name: N-[(1R)-2-[[4-(aminomethyl)phenyl]methylamino]-2-oxo-1-phenylethyl]-3-carbamimidoylbenzamide Traditional Name: 3-amidino-N-[(1R)-2-[[4-(aminomethyl)benzyl]amino]-2-keto-1-phenyl-ethyl]benzamide Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NCC2=CC=C(C=C2)CN)NC(=O)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)NCC2=CC=C(C=C2)CN)NC(=O)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C24H25N5O2/c25-14-16-9-11-17(12-10-16)15-28-24(31)21(18-5-2-1-3-6-18)29-23(30)20-8-4-7-19(13-20)22(26)27/h1-13,21H,14-15,25H2,(H3,26,27)(H,28,31)(H,29,30)/t21-/m1/s1