N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(3-ethyl-5,6-dimethoxy-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butyramide Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC(=C(C=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)OC)OC)OC

Isomeric SMILES

CCN1C2=CC(=C(C=C2SC1=NC(=O)CCCSC3=CC=C(C=C3)OC)OC)OC

InChI

InChI=1S/C22H26N2O4S2/c1-5-24-17-13-18(27-3)19(28-4)14-20(17)30-22(24)23-21(25)7-6-12-29-16-10-8-15(26-2)9-11-16/h8-11,13-14H,5-7,12H2,1-4H3