3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-methoxyphenyl)methyl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-methoxyphenyl)methyl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-methoxyphenyl)methyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-[(4-methoxyphenyl)methyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(4-methoxyphenyl)methyl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-p-anisyl-propionamide Formula: C18H18N2O2S2 MolecularWeight: 358.47772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H18N2O2S2/c1-22-14-8-6-13(7-9-14)12-19-17(21)10-11-23-18-20-15-4-2-3-5-16(15)24-18/h2-9H,10-12H2,1H3,(H,19,21)