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

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonyl-amino]ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[methyl-[(1-propan-2-yl-5-benzotriazolyl)sulfonyl]amino]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-[methyl-(1-propan-2-ylbenzotriazol-5-yl)sulfonylamino]acetamide Traditional Name: N-(4-fluorobenzyl)-2-[(1-isopropylbenzotriazol-5-yl)sulfonyl-methyl-amino]acetamide Formula: C19H22FN5O3S MolecularWeight: 419.473083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(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/C19H22FN5O3S/c1-13(2)25-18-9-8-16(10-17(18)22-23-25)29(27,28)24(3)12-19(26)21-11-14-4-6-15(20)7-5-14/h4-10,13H,11-12H2,1-3H3,(H,21,26)