N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2-phenylsulfanyl-propanamide Openeye Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-2-phenylsulfanyl-propanamide CAS Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]-2-(phenylthio)propanamide IUPAC Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-2-phenylsulfanylpropanamide Traditional Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-2-(phenylthio)propionamide Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC3=C(C=C2)OCCO3)SC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CC3=C(C=C2)OCCO3)SC4=CC=CC=C4

InChI

InChI=1S/C20H18N2O3S2/c1-13(27-15-5-3-2-4-6-15)19(23)22-20-21-16(12-26-20)14-7-8-17-18(11-14)25-10-9-24-17/h2-8,11-13H,9-10H2,1H3,(H,21,22,23)