3-[3,5-bis(chloranyl)-2-methoxy-phenyl]-N-(6-butyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: 3-[3,5-bis(chloranyl)-2-methoxy-phenyl]-N-(6-butyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3,5-dichloro-2-methoxy-phenyl)prop-2-enamide CAS Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3,5-dichloro-2-methoxyphenyl)-2-propenamide IUPAC Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamide Traditional Name: N-(6-butyl-1,3-benzothiazol-2-yl)-3-(3,5-dichloro-2-methoxy-phenyl)acrylamide Formula: C21H20Cl2N2O2S MolecularWeight: 435.3667

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC3=CC(=CC(=C3OC)Cl)Cl

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC3=CC(=CC(=C3OC)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O2S/c1-3-4-5-13-6-8-17-18(10-13)28-21(24-17)25-19(26)9-7-14-11-15(22)12-16(23)20(14)27-2/h6-12H,3-5H2,1-2H3,(H,24,25,26)