2-[2-(benzotriazol-1-yl)ethanoyl-(thiophen-2-ylmethyl)amino]-N-tert-butyl-2-(4-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(thiophen-2-ylmethyl)amino]-N-tert-butyl-2-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(2-thienylmethyl)amino]-N-tert-butyl-2-(4-morpholinophenyl)acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-(thiophen-2-ylmethyl)amino]-N-tert-butyl-2-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(thiophen-2-ylmethyl)amino]-N-tert-butyl-2-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(2-thenyl)amino]-N-tert-butyl-2-(4-morpholinophenyl)acetamide Formula: C29H34N6O3S MolecularWeight: 546.68366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=C(C=C1)N2CCOCC2)N(CC3=CC=CS3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC(C)(C)NC(=O)C(C1=CC=C(C=C1)N2CCOCC2)N(CC3=CC=CS3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C29H34N6O3S/c1-29(2,3)30-28(37)27(21-10-12-22(13-11-21)33-14-16-38-17-15-33)34(19-23-7-6-18-39-23)26(36)20-35-25-9-5-4-8-24(25)31-32-35/h4-13,18,27H,14-17,19-20H2,1-3H3,(H,30,37)