N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-phenylsulfanyl-propanamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-2-phenylsulfanyl-propanamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-2-(phenylthio)propanamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-phenylsulfanylpropanamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-2-(phenylthio)propionamide Formula: C19H16N2O3S2 MolecularWeight: 384.47194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC3=C(C=C2)OCO3)SC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CC3=C(C=C2)OCO3)SC4=CC=CC=C4

InChI

InChI=1S/C19H16N2O3S2/c1-12(26-14-5-3-2-4-6-14)18(22)21-19-20-15(10-25-19)13-7-8-16-17(9-13)24-11-23-16/h2-10,12H,11H2,1H3,(H,20,21,22)