4-(chloromethyl)-N-[4-methoxy-7-(5-methylthiophen-2-yl)-1,3-benzothiazol-2-yl]benzamide

Systemtic Name: 4-(chloromethyl)-N-[4-methoxy-7-(5-methylthiophen-2-yl)-1,3-benzothiazol-2-yl]benzamide Openeye Name: 4-(chloromethyl)-N-[4-methoxy-7-(5-methyl-2-thienyl)-1,3-benzothiazol-2-yl]benzamide CAS Name: 4-(chloromethyl)-N-[4-methoxy-7-(5-methyl-2-thiophenyl)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-(chloromethyl)-N-[4-methoxy-7-(5-methylthiophen-2-yl)-1,3-benzothiazol-2-yl]benzamide Traditional Name: 4-(chloromethyl)-N-[4-methoxy-7-(5-methyl-2-thienyl)-1,3-benzothiazol-2-yl]benzamide Formula: C21H17ClN2O2S2 MolecularWeight: 428.95488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=C3C(=C(C=C2)OC)N=C(S3)NC(=O)C4=CC=C(C=C4)CCl

Isomeric SMILES

CC1=CC=C(S1)C2=C3C(=C(C=C2)OC)N=C(S3)NC(=O)C4=CC=C(C=C4)CCl

InChI

InChI=1S/C21H17ClN2O2S2/c1-12-3-10-17(27-12)15-8-9-16(26-2)18-19(15)28-21(23-18)24-20(25)14-6-4-13(11-22)5-7-14/h3-10H,11H2,1-2H3,(H,23,24,25)