N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolyl]-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-[2-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-methyl-pyrazol-3-yl]-4-[(4-methoxyphenyl)thio]butyramide Formula: C24H26N4O2S2 MolecularWeight: 466.61884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)CCCSC4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(=CC(=N3)C)NC(=O)CCCSC4=CC=C(C=C4)OC)C

InChI

InChI=1S/C24H26N4O2S2/c1-15-12-16(2)23-20(13-15)32-24(26-23)28-21(14-17(3)27-28)25-22(29)6-5-11-31-19-9-7-18(30-4)8-10-19/h7-10,12-14H,5-6,11H2,1-4H3,(H,25,29)