(4-tert-butylphenyl)-[(3S)-1-(5-methylpyrazin-2-yl)carbonylpiperidin-3-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[(3S)-1-(5-methylpyrazin-2-yl)carbonylpiperidin-3-yl]methanone Openeye Name: (4-tert-butylphenyl)-[(3S)-1-(5-methylpyrazine-2-carbonyl)-3-piperidyl]methanone CAS Name: (4-tert-butylphenyl)-[(3S)-1-[(5-methyl-2-pyrazinyl)-oxomethyl]-3-piperidinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[(3S)-1-(5-methylpyrazine-2-carbonyl)piperidin-3-yl]methanone Traditional Name: (4-tert-butylphenyl)-[(3S)-1-(5-methylpyrazinoyl)-3-piperidyl]methanone Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N2CCC[C@@H](C2)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H27N3O2/c1-15-12-24-19(13-23-15)21(27)25-11-5-6-17(14-25)20(26)16-7-9-18(10-8-16)22(2,3)4/h7-10,12-13,17H,5-6,11,14H2,1-4H3/t17-/m0/s1