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

Systemtic Name: 2-[(4-acetamidophenyl)-[2-(benzotriazol-1-yl)ethanoyl]amino]-N-cyclopentyl-2-thiophen-3-yl-ethanamide Openeye Name: 2-(4-acetamido-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-cyclopentyl-2-(3-thienyl)acetamide CAS Name: 2-(4-acetamido-N-[2-(1-benzotriazolyl)-1-oxoethyl]anilino)-N-cyclopentyl-2-(3-thiophenyl)acetamide IUPAC Name: 2-(4-acetamido-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-cyclopentyl-2-thiophen-3-ylacetamide Traditional Name: 2-(4-acetamido-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-cyclopentyl-2-(3-thienyl)acetamide Formula: C27H28N6O3S MolecularWeight: 516.61462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N(C(C2=CSC=C2)C(=O)NC3CCCC3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N(C(C2=CSC=C2)C(=O)NC3CCCC3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C27H28N6O3S/c1-18(34)28-21-10-12-22(13-11-21)33(25(35)16-32-24-9-5-4-8-23(24)30-31-32)26(19-14-15-37-17-19)27(36)29-20-6-2-3-7-20/h4-5,8-15,17,20,26H,2-3,6-7,16H2,1H3,(H,28,34)(H,29,36)