N-(3-methyl-4-propan-2-yl-phenyl)-3-(pyrazin-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-(3-methyl-4-propan-2-yl-phenyl)-3-(pyrazin-2-ylsulfanylmethyl)benzamide Openeye Name: N-(4-isopropyl-3-methyl-phenyl)-3-(pyrazin-2-ylsulfanylmethyl)benzamide CAS Name: N-(3-methyl-4-propan-2-ylphenyl)-3-[(2-pyrazinylthio)methyl]benzamide IUPAC Name: N-(3-methyl-4-propan-2-ylphenyl)-3-(pyrazin-2-ylsulfanylmethyl)benzamide Traditional Name: N-(4-isopropyl-3-methyl-phenyl)-3-[(pyrazin-2-ylthio)methyl]benzamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)CSC3=NC=CN=C3)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)CSC3=NC=CN=C3)C(C)C

InChI

InChI=1S/C22H23N3OS/c1-15(2)20-8-7-19(11-16(20)3)25-22(26)18-6-4-5-17(12-18)14-27-21-13-23-9-10-24-21/h4-13,15H,14H2,1-3H3,(H,25,26)