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

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(thiophen-2-ylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(2-thienylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-(thiophen-2-ylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(thiophen-2-ylmethyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(2-thenyl)amino]-N-cyclohexyl-2-(3,4-dimethoxyphenyl)acetamide Formula: C29H33N5O4S MolecularWeight: 547.66842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C(=O)NC2CCCCC2)N(CC3=CC=CS3)C(=O)CN4C5=CC=CC=C5N=N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C(=O)NC2CCCCC2)N(CC3=CC=CS3)C(=O)CN4C5=CC=CC=C5N=N4)OC

InChI

InChI=1S/C29H33N5O4S/c1-37-25-15-14-20(17-26(25)38-2)28(29(36)30-21-9-4-3-5-10-21)33(18-22-11-8-16-39-22)27(35)19-34-24-13-7-6-12-23(24)31-32-34/h6-8,11-17,21,28H,3-5,9-10,18-19H2,1-2H3,(H,30,36)