N-(4-bromanyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(4-bromanyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(4-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(4-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(4-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(4-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butyramide Formula: C19H19BrN2O2S2 MolecularWeight: 451.40036

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC=C2Br)SC1=NC(=O)CCCSC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C2=C(C=CC=C2Br)SC1=NC(=O)CCCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H19BrN2O2S2/c1-22-18-15(20)5-3-6-16(18)26-19(22)21-17(23)7-4-12-25-14-10-8-13(24-2)9-11-14/h3,5-6,8-11H,4,7,12H2,1-2H3