N-[(4S)-2,2-dimethyloxan-4-yl]-1-(3-phenylpropyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[(4S)-2,2-dimethyloxan-4-yl]-1-(3-phenylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-1-(3-phenylpropyl)triazole-4-carboxamide CAS Name: N-[(4S)-2,2-dimethyl-4-oxanyl]-1-(3-phenylpropyl)-4-triazolecarboxamide IUPAC Name: N-[(4S)-2,2-dimethyloxan-4-yl]-1-(3-phenylpropyl)triazole-4-carboxamide Traditional Name: N-[(4S)-2,2-dimethyltetrahydropyran-4-yl]-1-(3-phenylpropyl)triazole-4-carboxamide Formula: C19H26N4O2 MolecularWeight: 342.43534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCO1)NC(=O)C2=CN(N=N2)CCCC3=CC=CC=C3)C

Isomeric SMILES

CC1(C[C@H](CCO1)NC(=O)C2=CN(N=N2)CCCC3=CC=CC=C3)C

InChI

InChI=1S/C19H26N4O2/c1-19(2)13-16(10-12-25-19)20-18(24)17-14-23(22-21-17)11-6-9-15-7-4-3-5-8-15/h3-5,7-8,14,16H,6,9-13H2,1-2H3,(H,20,24)/t16-/m0/s1