N-[3-(1,3-dithian-2-yl)phenyl]-3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-[3-(1,3-dithian-2-yl)phenyl]-3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-[3-(1,3-dithian-2-yl)phenyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-[3-(1,3-dithian-2-yl)phenyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-[3-(1,3-dithian-2-yl)phenyl]-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-[3-(1,3-dithian-2-yl)phenyl]-3-(2-keto-1,3-benzoxazol-3-yl)propionamide Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)CCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1CSC(SC1)C2=CC(=CC=C2)NC(=O)CCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C20H20N2O3S2/c23-18(9-10-22-16-7-1-2-8-17(16)25-20(22)24)21-15-6-3-5-14(13-15)19-26-11-4-12-27-19/h1-3,5-8,13,19H,4,9-12H2,(H,21,23)