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

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(thiophen-2-ylmethyl)amino]-N-cyclohexyl-2-(4-ethoxyphenyl)ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(2-thienylmethyl)amino]-N-cyclohexyl-2-(4-ethoxyphenyl)acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-(thiophen-2-ylmethyl)amino]-N-cyclohexyl-2-(4-ethoxyphenyl)acetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(thiophen-2-ylmethyl)amino]-N-cyclohexyl-2-(4-ethoxyphenyl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(2-thenyl)amino]-N-cyclohexyl-2-p-phenetyl-acetamide Formula: C29H33N5O3S MolecularWeight: 531.66902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(CC3=CC=CS3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(CC3=CC=CS3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C29H33N5O3S/c1-2-37-23-16-14-21(15-17-23)28(29(36)30-22-9-4-3-5-10-22)33(19-24-11-8-18-38-24)27(35)20-34-26-13-7-6-12-25(26)31-32-34/h6-8,11-18,22,28H,2-5,9-10,19-20H2,1H3,(H,30,36)