(E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-(6-methylsulfonyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-(6-mesyl-3-propyl-1,3-benzothiazol-2-ylidene)-3-(2-thienyl)acrylamide Formula: C18H18N2O3S3 MolecularWeight: 406.54212

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C=CC3=CC=CS3

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C18H18N2O3S3/c1-3-10-20-15-8-7-14(26(2,22)23)12-16(15)25-18(20)19-17(21)9-6-13-5-4-11-24-13/h4-9,11-12H,3,10H2,1-2H3/b9-6+,19-18?