N-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-4-(1,2,4-triazol-1-yl)butanamide

Systemtic Name: N-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-4-(1,2,4-triazol-1-yl)butanamide Openeye Name: N-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-4-(1,2,4-triazol-1-yl)butanamide CAS Name: N-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-4-(1,2,4-triazol-1-yl)butanamide IUPAC Name: N-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-4-(1,2,4-triazol-1-yl)butanamide Traditional Name: N-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-4-(1,2,4-triazol-1-yl)butyramide Formula: C21H26N6O MolecularWeight: 378.47074

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(C1)N(N=C2)C3=CC=CC=C3)NC(=O)CCCN4C=NC=N4)C

Isomeric SMILES

CC1(C[C@@H](C2=C(C1)N(N=C2)C3=CC=CC=C3)NC(=O)CCCN4C=NC=N4)C

InChI

InChI=1S/C21H26N6O/c1-21(2)11-18(25-20(28)9-6-10-26-15-22-14-24-26)17-13-23-27(19(17)12-21)16-7-4-3-5-8-16/h3-5,7-8,13-15,18H,6,9-12H2,1-2H3,(H,25,28)/t18-/m0/s1