6-(4-chlorophenyl)-N-[(2R)-2-cyclopropyl-2-oxidanyl-propyl]-5-(3-methylbutylamino)pyrazine-2-carboxamide

Systemtic Name: 6-(4-chlorophenyl)-N-[(2R)-2-cyclopropyl-2-oxidanyl-propyl]-5-(3-methylbutylamino)pyrazine-2-carboxamide Openeye Name: 6-(4-chlorophenyl)-N-[(2R)-2-cyclopropyl-2-hydroxy-propyl]-5-(isopentylamino)pyrazine-2-carboxamide CAS Name: 6-(4-chlorophenyl)-N-[(2R)-2-cyclopropyl-2-hydroxypropyl]-5-(3-methylbutylamino)-2-pyrazinecarboxamide IUPAC Name: 6-(4-chlorophenyl)-N-[(2R)-2-cyclopropyl-2-hydroxypropyl]-5-(3-methylbutylamino)pyrazine-2-carboxamide Traditional Name: 6-(4-chlorophenyl)-N-[(2R)-2-cyclopropyl-2-hydroxy-propyl]-5-(isoamylamino)pyrazinamide Formula: C22H29ClN4O2 MolecularWeight: 416.94426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC=C(N=C1C2=CC=C(C=C2)Cl)C(=O)NCC(C)(C3CC3)O

Isomeric SMILES

CC(C)CCNC1=NC=C(N=C1C2=CC=C(C=C2)Cl)C(=O)NC[C@@](C)(C3CC3)O

InChI

InChI=1S/C22H29ClN4O2/c1-14(2)10-11-24-20-19(15-4-8-17(23)9-5-15)27-18(12-25-20)21(28)26-13-22(3,29)16-6-7-16/h4-5,8-9,12,14,16,29H,6-7,10-11,13H2,1-3H3,(H,24,25)(H,26,28)/t22-/m0/s1