N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-(2,3,4-trimethoxyphenyl)ethanamide

Systemtic Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-(2,3,4-trimethoxyphenyl)ethanamide Openeye Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-(2,3,4-trimethoxyphenyl)acetamide CAS Name: N-[1-(1-benzotriazolylmethyl)-4-pyrazolyl]-2-(2,3,4-trimethoxyphenyl)acetamide IUPAC Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-(2,3,4-trimethoxyphenyl)acetamide Traditional Name: N-[1-(benzotriazol-1-ylmethyl)pyrazol-4-yl]-2-(2,3,4-trimethoxyphenyl)acetamide Formula: C21H22N6O4 MolecularWeight: 422.43718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC(=O)NC2=CN(N=C2)CN3C4=CC=CC=C4N=N3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CC(=O)NC2=CN(N=C2)CN3C4=CC=CC=C4N=N3)OC)OC

InChI

InChI=1S/C21H22N6O4/c1-29-18-9-8-14(20(30-2)21(18)31-3)10-19(28)23-15-11-22-26(12-15)13-27-17-7-5-4-6-16(17)24-25-27/h4-9,11-12H,10,13H2,1-3H3,(H,23,28)