2-[2-(benzotriazol-1-yl)ethanoyl-(4-ethanoylphenyl)amino]-N-cyclohexyl-2-thiophen-2-yl-ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(4-ethanoylphenyl)amino]-N-cyclohexyl-2-thiophen-2-yl-ethanamide Openeye Name: 2-(4-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-cyclohexyl-2-(2-thienyl)acetamide CAS Name: 2-(4-acetyl-N-[2-(1-benzotriazolyl)-1-oxoethyl]anilino)-N-cyclohexyl-2-thiophen-2-ylacetamide IUPAC Name: 2-(4-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-cyclohexyl-2-thiophen-2-ylacetamide Traditional Name: 2-(4-acetyl-N-[2-(benzotriazol-1-yl)acetyl]anilino)-N-cyclohexyl-2-(2-thienyl)acetamide Formula: C28H29N5O3S MolecularWeight: 515.62656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N(C(C2=CC=CS2)C(=O)NC3CCCCC3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N(C(C2=CC=CS2)C(=O)NC3CCCCC3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C28H29N5O3S/c1-19(34)20-13-15-22(16-14-20)33(26(35)18-32-24-11-6-5-10-23(24)30-31-32)27(25-12-7-17-37-25)28(36)29-21-8-3-2-4-9-21/h5-7,10-17,21,27H,2-4,8-9,18H2,1H3,(H,29,36)