N-(1,3-benzodioxol-5-yl)-2-[2-(benzotriazol-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]-2-phenyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[2-(benzotriazol-1-yl)ethanoyl-(pyridin-3-ylmethyl)amino]-2-phenyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(benzotriazol-1-yl)acetyl]-(3-pyridylmethyl)amino]-2-phenyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(1-benzotriazolyl)-1-oxoethyl]-(3-pyridinylmethyl)amino]-2-phenylacetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(benzotriazol-1-yl)acetyl]-(pyridin-3-ylmethyl)amino]-2-phenylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[2-(benzotriazol-1-yl)acetyl]-(3-pyridylmethyl)amino]-2-phenyl-acetamide Formula: C29H24N6O4 MolecularWeight: 520.53866

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C(C3=CC=CC=C3)N(CC4=CN=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C(C3=CC=CC=C3)N(CC4=CN=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C29H24N6O4/c36-27(18-35-24-11-5-4-10-23(24)32-33-35)34(17-20-7-6-14-30-16-20)28(21-8-2-1-3-9-21)29(37)31-22-12-13-25-26(15-22)39-19-38-25/h1-16,28H,17-19H2,(H,31,37)