1-methylsulfonyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]-2,3-dihydroindole-5-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]-2,3-dihydroindole-5-carboxamide Openeye Name: 1-methylsulfonyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]indoline-5-carboxamide CAS Name: 1-methylsulfonyl-N-[4-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]phenyl]-2,3-dihydroindole-5-carboxamide IUPAC Name: 1-methylsulfonyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]-2,3-dihydroindole-5-carboxamide Traditional Name: 1-mesyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]indoline-5-carboxamide Formula: C21H22N6O4S MolecularWeight: 454.50218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C)N4C=NC=N4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C)N4C=NC=N4

InChI

InChI=1S/C21H22N6O4S/c1-14(26-13-22-12-23-26)20(28)24-17-4-6-18(7-5-17)25-21(29)16-3-8-19-15(11-16)9-10-27(19)32(2,30)31/h3-8,11-14H,9-10H2,1-2H3,(H,24,28)(H,25,29)