N-(4,7-dimethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(4,7-dimethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-phenylsulfanyl-butanamide Openeye Name: N-(3-allyl-4,7-dimethoxy-1,3-benzothiazol-2-ylidene)-4-phenylsulfanyl-butanamide CAS Name: N-(4,7-dimethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-(phenylthio)butanamide IUPAC Name: N-(4,7-dimethoxy-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)-4-phenylsulfanylbutanamide Traditional Name: N-(3-allyl-4,7-dimethoxy-1,3-benzothiazol-2-ylidene)-4-(phenylthio)butyramide Formula: C22H24N2O3S2 MolecularWeight: 428.56756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=NC(=O)CCCSC3=CC=CC=C3)N2CC=C

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=NC(=O)CCCSC3=CC=CC=C3)N2CC=C

InChI

InChI=1S/C22H24N2O3S2/c1-4-14-24-20-17(26-2)12-13-18(27-3)21(20)29-22(24)23-19(25)11-8-15-28-16-9-6-5-7-10-16/h4-7,9-10,12-13H,1,8,11,14-15H2,2-3H3