5-chloranyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1-benzothiazole-3-carboxamide

Systemtic Name: 5-chloranyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1-benzothiazole-3-carboxamide Openeye Name: 5-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1-benzothiazole-3-carboxamide CAS Name: 5-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1-benzothiazole-3-carboxamide IUPAC Name: 5-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1-benzothiazole-3-carboxamide Traditional Name: 5-chloro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2,1-benzothiazole-3-carboxamide Formula: C22H14ClN3OS2 MolecularWeight: 435.94906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=C5C=C(C=CC5=NS4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)C4=C5C=C(C=CC5=NS4)Cl

InChI

InChI=1S/C22H14ClN3OS2/c1-12-2-8-18-19(10-12)28-22(25-18)13-3-6-15(7-4-13)24-21(27)20-16-11-14(23)5-9-17(16)26-29-20/h2-11H,1H3,(H,24,27)