2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-(3-morpholin-4-ylpropyl)ethanamide

Systemtic Name: 2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-(3-morpholin-4-ylpropyl)ethanamide Openeye Name: 2-[methyl-(1-sec-butylbenzotriazol-5-yl)sulfonyl-amino]-N-(3-morpholinopropyl)acetamide CAS Name: 2-[(1-butan-2-yl-5-benzotriazolyl)sulfonyl-methylamino]-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: 2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methylamino]-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: 2-[methyl-(1-sec-butylbenzotriazol-5-yl)sulfonyl-amino]-N-(3-morpholinopropyl)acetamide Formula: C20H32N6O4S MolecularWeight: 452.57088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NCCCN3CCOCC3)N=N1

Isomeric SMILES

CCC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NCCCN3CCOCC3)N=N1

InChI

InChI=1S/C20H32N6O4S/c1-4-16(2)26-19-7-6-17(14-18(19)22-23-26)31(28,29)24(3)15-20(27)21-8-5-9-25-10-12-30-13-11-25/h6-7,14,16H,4-5,8-13,15H2,1-3H3,(H,21,27)