N-[3-(1,3-benzothiazol-2-yl)-4,5-dimethyl-thiophen-2-yl]-4-ethoxy-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-4,5-dimethyl-thiophen-2-yl]-4-ethoxy-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-4,5-dimethyl-2-thienyl]-4-ethoxy-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-4,5-dimethyl-2-thiophenyl]-4-ethoxybenzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-4,5-dimethylthiophen-2-yl]-4-ethoxybenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-4,5-dimethyl-2-thienyl]-4-ethoxy-benzamide Formula: C22H20N2O2S2 MolecularWeight: 408.5364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)C)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)C)C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N2O2S2/c1-4-26-16-11-9-15(10-12-16)20(25)24-22-19(13(2)14(3)27-22)21-23-17-7-5-6-8-18(17)28-21/h5-12H,4H2,1-3H3,(H,24,25)