2-[1,3-benzodioxol-5-yl-[2-(benzotriazol-1-yl)ethanoyl]amino]-N-(phenylmethyl)-2-thiophen-2-yl-ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl-[2-(benzotriazol-1-yl)ethanoyl]amino]-N-(phenylmethyl)-2-thiophen-2-yl-ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl-[2-(benzotriazol-1-yl)acetyl]amino]-N-benzyl-2-(2-thienyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-yl-[2-(1-benzotriazolyl)-1-oxoethyl]amino]-N-(phenylmethyl)-2-thiophen-2-ylacetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl-[2-(benzotriazol-1-yl)acetyl]amino]-N-benzyl-2-thiophen-2-ylacetamide Traditional Name: 2-[1,3-benzodioxol-5-yl-[2-(benzotriazol-1-yl)acetyl]amino]-N-benzyl-2-(2-thienyl)acetamide Formula: C28H23N5O4S MolecularWeight: 525.57832

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N(C(C3=CC=CS3)C(=O)NCC4=CC=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N(C(C3=CC=CS3)C(=O)NCC4=CC=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C28H23N5O4S/c34-26(17-32-22-10-5-4-9-21(22)30-31-32)33(20-12-13-23-24(15-20)37-18-36-23)27(25-11-6-14-38-25)28(35)29-16-19-7-2-1-3-8-19/h1-15,27H,16-18H2,(H,29,35)