N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide

Systemtic Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide Openeye Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenylsulfanyl-propanamide CAS Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-(phenylthio)propanamide IUPAC Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-phenylsulfanylpropanamide Traditional Name: N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-3-(phenylthio)propionamide Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)NC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)NC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O3S2/c1-22-13-8-9-14(23-2)17-16(13)20-18(25-17)19-15(21)10-11-24-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3,(H,19,20,21)