2-[2-(benzotriazol-1-yl)ethanoyl-(2,4-dimethoxyphenyl)amino]-N-cyclopentyl-2-thiophen-3-yl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(2,4-dimethoxyphenyl)amino]-N-cyclopentyl-2-thiophen-3-yl-ethanamide Openeye Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-2,4-dimethoxy-anilino)-N-cyclopentyl-2-(3-thienyl)acetamide CAS Name: 2-(N-[2-(1-benzotriazolyl)-1-oxoethyl]-2,4-dimethoxyanilino)-N-cyclopentyl-2-(3-thiophenyl)acetamide IUPAC Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-2,4-dimethoxyanilino)-N-cyclopentyl-2-thiophen-3-ylacetamide Traditional Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-2,4-dimethoxy-anilino)-N-cyclopentyl-2-(3-thienyl)acetamide Formula: C27H29N5O4S MolecularWeight: 519.61526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N(C(C2=CSC=C2)C(=O)NC3CCCC3)C(=O)CN4C5=CC=CC=C5N=N4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N(C(C2=CSC=C2)C(=O)NC3CCCC3)C(=O)CN4C5=CC=CC=C5N=N4)OC

InChI

InChI=1S/C27H29N5O4S/c1-35-20-11-12-23(24(15-20)36-2)32(25(33)16-31-22-10-6-5-9-21(22)29-30-31)26(18-13-14-37-17-18)27(34)28-19-7-3-4-8-19/h5-6,9-15,17,19,26H,3-4,7-8,16H2,1-2H3,(H,28,34)