N-(3-fluoranyl-4-methoxy-phenyl)-1-propan-2-yl-N-propylsulfonyl-benzotriazole-5-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methoxy-phenyl)-1-propan-2-yl-N-propylsulfonyl-benzotriazole-5-carboxamide Openeye Name: N-(3-fluoro-4-methoxy-phenyl)-1-isopropyl-N-propylsulfonyl-benzotriazole-5-carboxamide CAS Name: N-(3-fluoro-4-methoxyphenyl)-1-propan-2-yl-N-propylsulfonyl-5-benzotriazolecarboxamide IUPAC Name: N-(3-fluoro-4-methoxyphenyl)-1-propan-2-yl-N-propylsulfonylbenzotriazole-5-carboxamide Traditional Name: N-(3-fluoro-4-methoxy-phenyl)-1-isopropyl-N-propylsulfonyl-benzotriazole-5-carboxamide Formula: C20H23FN4O4S MolecularWeight: 434.484423

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)C2=CC3=C(C=C2)N(N=N3)C(C)C

Isomeric SMILES

CCCS(=O)(=O)N(C1=CC(=C(C=C1)OC)F)C(=O)C2=CC3=C(C=C2)N(N=N3)C(C)C

InChI

InChI=1S/C20H23FN4O4S/c1-5-10-30(27,28)25(15-7-9-19(29-4)16(21)12-15)20(26)14-6-8-18-17(11-14)22-23-24(18)13(2)3/h6-9,11-13H,5,10H2,1-4H3