N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]carbonylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]carbonylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[3-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C23H25N3O4S MolecularWeight: 439.5273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)C4=CSCCO4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)C4=CSCCO4

InChI

InChI=1S/C23H25N3O4S/c1-29-20-7-5-19(6-8-20)25-9-11-26(12-10-25)23(28)17-3-2-4-18(15-17)24-22(27)21-16-31-14-13-30-21/h2-8,15-16H,9-14H2,1H3,(H,24,27)