1-(4-cyanobutyl)-N-[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxidanylidene-butan-2-yl]indazole-3-carboxamide

Systemtic Name: 1-(4-cyanobutyl)-N-[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxidanylidene-butan-2-yl]indazole-3-carboxamide Openeye Name: 1-(4-cyanobutyl)-N-[(1S)-1-(2-hydroxyethylcarbamoyl)-2,2-dimethyl-propyl]indazole-3-carboxamide CAS Name: 1-(4-cyanobutyl)-N-[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxobutan-2-yl]-3-indazolecarboxamide IUPAC Name: 1-(4-cyanobutyl)-N-[(2S)-1-(2-hydroxyethylamino)-3,3-dimethyl-1-oxobutan-2-yl]indazole-3-carboxamide Traditional Name: 1-(4-cyanobutyl)-N-[(1S)-1-(2-hydroxyethylcarbamoyl)-2,2-dimethyl-propyl]indazole-3-carboxamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)NCCO)NC(=O)C1=NN(C2=CC=CC=C21)CCCCC#N

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)NCCO)NC(=O)C1=NN(C2=CC=CC=C21)CCCCC#N

InChI

InChI=1S/C21H29N5O3/c1-21(2,3)18(20(29)23-12-14-27)24-19(28)17-15-9-5-6-10-16(15)26(25-17)13-8-4-7-11-22/h5-6,9-10,18,27H,4,7-8,12-14H2,1-3H3,(H,23,29)(H,24,28)/t18-/m1/s1