(2R)-2-[2-(benzotriazol-1-yl)ethanoyl-phenethyl-amino]-N-(2-methoxyethyl)-2-thiophen-2-yl-ethanamide

Systemtic Name: (2R)-2-[2-(benzotriazol-1-yl)ethanoyl-phenethyl-amino]-N-(2-methoxyethyl)-2-thiophen-2-yl-ethanamide Openeye Name: (2R)-2-[[2-(benzotriazol-1-yl)acetyl]-phenethyl-amino]-N-(2-methoxyethyl)-2-(2-thienyl)acetamide CAS Name: (2R)-2-[[2-(1-benzotriazolyl)-1-oxoethyl]-phenethylamino]-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide IUPAC Name: (2R)-2-[[2-(benzotriazol-1-yl)acetyl]-phenethylamino]-N-(2-methoxyethyl)-2-thiophen-2-ylacetamide Traditional Name: (2R)-2-[[2-(benzotriazol-1-yl)acetyl]-phenethyl-amino]-N-(2-methoxyethyl)-2-(2-thienyl)acetamide Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C(C1=CC=CS1)N(CCC2=CC=CC=C2)C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

COCCNC(=O)[C@H](C1=CC=CS1)N(CCC2=CC=CC=C2)C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C25H27N5O3S/c1-33-16-14-26-25(32)24(22-12-7-17-34-22)29(15-13-19-8-3-2-4-9-19)23(31)18-30-21-11-6-5-10-20(21)27-28-30/h2-12,17,24H,13-16,18H2,1H3,(H,26,32)/t24-/m0/s1