N-[2-methyl-5-(4-phenylbutan-2-ylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[2-methyl-5-(4-phenylbutan-2-ylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[2-methyl-5-[(1-methyl-3-phenyl-propyl)carbamoyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-methyl-5-[oxo-(4-phenylbutan-2-ylamino)methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[2-methyl-5-(4-phenylbutan-2-ylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[2-methyl-5-[(1-methyl-3-phenyl-propyl)carbamoyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(C)CCC2=CC=CC=C2)NC(=O)C3=CSCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(C)CCC2=CC=CC=C2)NC(=O)C3=CSCCO3

InChI

InChI=1S/C23H26N2O3S/c1-16-8-11-19(14-20(16)25-23(27)21-15-29-13-12-28-21)22(26)24-17(2)9-10-18-6-4-3-5-7-18/h3-8,11,14-15,17H,9-10,12-13H2,1-2H3,(H,24,26)(H,25,27)