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

Systemtic Name: 2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methyl-amino]-N-[(4-fluorophenyl)methyl]ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[methyl-(1-sec-butylbenzotriazol-5-yl)sulfonyl-amino]acetamide CAS Name: 2-[(1-butan-2-yl-5-benzotriazolyl)sulfonyl-methylamino]-N-[(4-fluorophenyl)methyl]acetamide IUPAC Name: 2-[(1-butan-2-ylbenzotriazol-5-yl)sulfonyl-methylamino]-N-[(4-fluorophenyl)methyl]acetamide Traditional Name: N-(4-fluorobenzyl)-2-[methyl-(1-sec-butylbenzotriazol-5-yl)sulfonyl-amino]acetamide Formula: C20H24FN5O3S MolecularWeight: 433.499663

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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)NCC3=CC=C(C=C3)F)N=N1

Isomeric SMILES

CCC(C)N1C2=C(C=C(C=C2)S(=O)(=O)N(C)CC(=O)NCC3=CC=C(C=C3)F)N=N1

InChI

InChI=1S/C20H24FN5O3S/c1-4-14(2)26-19-10-9-17(11-18(19)23-24-26)30(28,29)25(3)13-20(27)22-12-15-5-7-16(21)8-6-15/h5-11,14H,4,12-13H2,1-3H3,(H,22,27)