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

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(4-ethylphenyl)amino]-N-cyclopentyl-2-thiophen-2-yl-ethanamide Openeye Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-ethyl-anilino)-N-cyclopentyl-2-(2-thienyl)acetamide CAS Name: 2-(N-[2-(1-benzotriazolyl)-1-oxoethyl]-4-ethylanilino)-N-cyclopentyl-2-thiophen-2-ylacetamide IUPAC Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-ethylanilino)-N-cyclopentyl-2-thiophen-2-ylacetamide Traditional Name: 2-(N-[2-(benzotriazol-1-yl)acetyl]-4-ethyl-anilino)-N-cyclopentyl-2-(2-thienyl)acetamide Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C(C2=CC=CS2)C(=O)NC3CCCC3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CCC1=CC=C(C=C1)N(C(C2=CC=CS2)C(=O)NC3CCCC3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C27H29N5O2S/c1-2-19-13-15-21(16-14-19)32(25(33)18-31-23-11-6-5-10-22(23)29-30-31)26(24-12-7-17-35-24)27(34)28-20-8-3-4-9-20/h5-7,10-17,20,26H,2-4,8-9,18H2,1H3,(H,28,34)