N-(2-azanyl-5-thiophen-2-yl-phenyl)-4-[(3-phenylpropanoylamino)methyl]benzamide

Systemtic Name: N-(2-azanyl-5-thiophen-2-yl-phenyl)-4-[(3-phenylpropanoylamino)methyl]benzamide Openeye Name: N-[2-amino-5-(2-thienyl)phenyl]-4-[(3-phenylpropanoylamino)methyl]benzamide CAS Name: N-(2-amino-5-thiophen-2-ylphenyl)-4-[[(1-oxo-3-phenylpropyl)amino]methyl]benzamide IUPAC Name: N-(2-amino-5-thiophen-2-ylphenyl)-4-[(3-phenylpropanoylamino)methyl]benzamide Traditional Name: N-[2-amino-5-(2-thienyl)phenyl]-4-[(hydrocinnamoylamino)methyl]benzamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NCC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C4=CC=CS4)N

InChI

InChI=1S/C27H25N3O2S/c28-23-14-13-22(25-7-4-16-33-25)17-24(23)30-27(32)21-11-8-20(9-12-21)18-29-26(31)15-10-19-5-2-1-3-6-19/h1-9,11-14,16-17H,10,15,18,28H2,(H,29,31)(H,30,32)