2-[2-(benzotriazol-1-yl)ethanoyl-(4-butan-2-ylphenyl)amino]-N-(oxolan-2-ylmethyl)-2-pyridin-4-yl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(4-butan-2-ylphenyl)amino]-N-(oxolan-2-ylmethyl)-2-pyridin-4-yl-ethanamide Openeye Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-sec-butyl-anilino)-2-(4-pyridyl)-N-(tetrahydrofuran-2-ylmethyl)acetamide CAS Name: 2-(N-[2-(1-benzotriazolyl)-1-oxoethyl]-4-butan-2-ylanilino)-N-(2-oxolanylmethyl)-2-pyridin-4-ylacetamide IUPAC Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-butan-2-ylanilino)-N-(oxolan-2-ylmethyl)-2-pyridin-4-ylacetamide Traditional Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-sec-butyl-anilino)-2-(4-pyridyl)-N-(tetrahydrofurfuryl)acetamide Formula: C30H34N6O3 MolecularWeight: 526.62936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)N(C(C2=CC=NC=C2)C(=O)NCC3CCCO3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)N(C(C2=CC=NC=C2)C(=O)NCC3CCCO3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C30H34N6O3/c1-3-21(2)22-10-12-24(13-11-22)36(28(37)20-35-27-9-5-4-8-26(27)33-34-35)29(23-14-16-31-17-15-23)30(38)32-19-25-7-6-18-39-25/h4-5,8-17,21,25,29H,3,6-7,18-20H2,1-2H3,(H,32,38)