2-[2-(benzotriazol-1-yl)ethanoyl-(3-ethanoylphenyl)amino]-N-(phenylmethyl)-2-thiophen-2-yl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(3-ethanoylphenyl)amino]-N-(phenylmethyl)-2-thiophen-2-yl-ethanamide Openeye Name: 2-(3-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-benzyl-2-(2-thienyl)acetamide CAS Name: 2-(3-acetyl-N-[2-(1-benzotriazolyl)-1-oxoethyl]anilino)-N-(phenylmethyl)-2-thiophen-2-ylacetamide IUPAC Name: 2-(3-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-benzyl-2-thiophen-2-ylacetamide Traditional Name: 2-(3-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-benzyl-2-(2-thienyl)acetamide Formula: C29H25N5O3S MolecularWeight: 523.6055

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N(C(C2=CC=CS2)C(=O)NCC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N(C(C2=CC=CS2)C(=O)NCC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C29H25N5O3S/c1-20(35)22-11-7-12-23(17-22)34(27(36)19-33-25-14-6-5-13-24(25)31-32-33)28(26-15-8-16-38-26)29(37)30-18-21-9-3-2-4-10-21/h2-17,28H,18-19H2,1H3,(H,30,37)