N-[(3-aminophenyl)methyl]-2-(5-carbamimidoyl-1-benzothiophen-2-yl)ethanamide

Systemtic Name: N-[(3-aminophenyl)methyl]-2-(5-carbamimidoyl-1-benzothiophen-2-yl)ethanamide Openeye Name: N-[(3-aminophenyl)methyl]-2-(5-carbamimidoylbenzothiophen-2-yl)acetamide CAS Name: N-[(3-aminophenyl)methyl]-2-(5-carbamimidoyl-1-benzothiophen-2-yl)acetamide IUPAC Name: N-[(3-aminophenyl)methyl]-2-(5-carbamimidoyl-1-benzothiophen-2-yl)acetamide Traditional Name: 2-(5-amidinobenzothiophen-2-yl)-N-(3-aminobenzyl)acetamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)CNC(=O)CC2=CC3=C(S2)C=CC(=C3)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)N)CNC(=O)CC2=CC3=C(S2)C=CC(=C3)C(=N)N

InChI

InChI=1S/C18H18N4OS/c19-14-3-1-2-11(6-14)10-22-17(23)9-15-8-13-7-12(18(20)21)4-5-16(13)24-15/h1-8H,9-10,19H2,(H3,20,21)(H,22,23)