N-[(2R)-1-(benzotriazol-1-yl)-3-methyl-butan-2-yl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide

Systemtic Name: N-[(2R)-1-(benzotriazol-1-yl)-3-methyl-butan-2-yl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Openeye Name: N-[(1R)-1-(benzotriazol-1-ylmethyl)-2-methyl-propyl]-1-methylsulfonyl-indoline-5-carboxamide CAS Name: N-[(2R)-1-(1-benzotriazolyl)-3-methylbutan-2-yl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide IUPAC Name: N-[(2R)-1-(benzotriazol-1-yl)-3-methylbutan-2-yl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Traditional Name: N-[(1R)-1-(benzotriazol-1-ylmethyl)-2-methyl-propyl]-1-mesyl-indoline-5-carboxamide Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN1C2=CC=CC=C2N=N1)NC(=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

Isomeric SMILES

CC(C)[C@H](CN1C2=CC=CC=C2N=N1)NC(=O)C3=CC4=C(C=C3)N(CC4)S(=O)(=O)C

InChI

InChI=1S/C21H25N5O3S/c1-14(2)18(13-25-20-7-5-4-6-17(20)23-24-25)22-21(27)16-8-9-19-15(12-16)10-11-26(19)30(3,28)29/h4-9,12,14,18H,10-11,13H2,1-3H3,(H,22,27)/t18-/m0/s1