3-methyl-N-[3-(2-methylpropyl)-4-propan-2-ylsulfanyl-phenyl]pyrazine-2-carboxamide

Systemtic Name: 3-methyl-N-[3-(2-methylpropyl)-4-propan-2-ylsulfanyl-phenyl]pyrazine-2-carboxamide Openeye Name: N-(3-isobutyl-4-isopropylsulfanyl-phenyl)-3-methyl-pyrazine-2-carboxamide CAS Name: 3-methyl-N-[3-(2-methylpropyl)-4-(propan-2-ylthio)phenyl]-2-pyrazinecarboxamide IUPAC Name: 3-methyl-N-[3-(2-methylpropyl)-4-propan-2-ylsulfanylphenyl]pyrazine-2-carboxamide Traditional Name: N-[3-isobutyl-4-(isopropylthio)phenyl]-3-methyl-pyrazinamide Formula: C19H25N3OS MolecularWeight: 343.4863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN=C1C(=O)NC2=CC(=C(C=C2)SC(C)C)CC(C)C

Isomeric SMILES

CC1=NC=CN=C1C(=O)NC2=CC(=C(C=C2)SC(C)C)CC(C)C

InChI

InChI=1S/C19H25N3OS/c1-12(2)10-15-11-16(6-7-17(15)24-13(3)4)22-19(23)18-14(5)20-8-9-21-18/h6-9,11-13H,10H2,1-5H3,(H,22,23)