N-[5-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-carbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[5-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-carbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[5-[[1-(1,3-benzothiazol-2-yl)ethyl-methylamino]-oxomethyl]-2-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-[1-(1,3-benzothiazol-2-yl)ethyl-methylcarbamoyl]-2-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[5-[1-(1,3-benzothiazol-2-yl)ethyl-methyl-carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide Formula: C22H18ClN3O2S2 MolecularWeight: 455.98022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H18ClN3O2S2/c1-13(21-25-16-6-3-4-7-18(16)30-21)26(2)22(28)14-9-10-15(23)17(12-14)24-20(27)19-8-5-11-29-19/h3-13H,1-2H3,(H,24,27)