(E)-N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-benzyl-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-benzyl-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-benzyl-N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-3-(2-thienyl)acrylamide Formula: C22H17ClN2OS2 MolecularWeight: 424.96618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CC=C3)C(=O)C=CC4=CC=CS4)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)N(CC3=CC=CC=C3)C(=O)/C=C/C4=CC=CS4)Cl

InChI

InChI=1S/C22H17ClN2OS2/c1-15-18(23)10-11-19-21(15)24-22(28-19)25(14-16-6-3-2-4-7-16)20(26)12-9-17-8-5-13-27-17/h2-13H,14H2,1H3/b12-9+