N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(p-tolylsulfanyl)propanamide CAS Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-[2-(4-ethoxy-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-3-(p-tolylthio)propionamide Formula: C23H24N4O2S2 MolecularWeight: 452.59226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)CCSC4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)CCSC4=CC=C(C=C4)C

InChI

InChI=1S/C23H24N4O2S2/c1-4-29-18-6-5-7-19-22(18)25-23(31-19)27-20(14-16(3)26-27)24-21(28)12-13-30-17-10-8-15(2)9-11-17/h5-11,14H,4,12-13H2,1-3H3,(H,24,28)