N-[5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)NC(=O)C4=CSCCO4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)NC(=O)C4=CSCCO4)C

InChI

InChI=1S/C25H29N3O3S/c1-17-5-4-6-22(19(17)3)27-9-11-28(12-10-27)25(30)20-8-7-18(2)21(15-20)26-24(29)23-16-32-14-13-31-23/h4-8,15-16H,9-14H2,1-3H3,(H,26,29)