2-[1-(4-methylphenyl)sulfonylpyrrol-2-yl]-3-[(5-methylpyrazin-2-yl)methyl]-1,3-thiazinan-4-one

Systemtic Name: 2-[1-(4-methylphenyl)sulfonylpyrrol-2-yl]-3-[(5-methylpyrazin-2-yl)methyl]-1,3-thiazinan-4-one Openeye Name: 3-[(5-methylpyrazin-2-yl)methyl]-2-[1-(p-tolylsulfonyl)pyrrol-2-yl]-1,3-thiazinan-4-one CAS Name: 2-[1-(4-methylphenyl)sulfonyl-2-pyrrolyl]-3-[(5-methyl-2-pyrazinyl)methyl]-1,3-thiazinan-4-one IUPAC Name: 2-[1-(4-methylphenyl)sulfonylpyrrol-2-yl]-3-[(5-methylpyrazin-2-yl)methyl]-1,3-thiazinan-4-one Traditional Name: 3-[(5-methylpyrazin-2-yl)methyl]-2-(1-tosylpyrrol-2-yl)-1,3-thiazinan-4-one Formula: C21H22N4O3S2 MolecularWeight: 442.55438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2C3N(C(=O)CCS3)CC4=NC=C(N=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2C3N(C(=O)CCS3)CC4=NC=C(N=C4)C

InChI

InChI=1S/C21H22N4O3S2/c1-15-5-7-18(8-6-15)30(27,28)25-10-3-4-19(25)21-24(20(26)9-11-29-21)14-17-13-22-16(2)12-23-17/h3-8,10,12-13,21H,9,11,14H2,1-2H3