N-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-2-(benzotriazol-1-yl)-N-(phenylmethyl)ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-2-(benzotriazol-1-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-2-(benzotriazol-1-yl)-N-benzyl-acetamide CAS Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-(1-benzotriazolyl)-N-(phenylmethyl)acetamide IUPAC Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-2-(benzotriazol-1-yl)-N-benzylacetamide Traditional Name: N-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-2-(benzotriazol-1-yl)-N-benzyl-acetamide Formula: C24H21N5O4 MolecularWeight: 443.45464

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CN(CC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CN(CC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C24H21N5O4/c30-23(25-18-10-11-21-22(12-18)33-16-32-21)14-28(13-17-6-2-1-3-7-17)24(31)15-29-20-9-5-4-8-19(20)26-27-29/h1-12H,13-16H2,(H,25,30)