2-chloranyl-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]-5-(1,2,3-triazol-1-yl)benzamide

Systemtic Name: 2-chloranyl-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]-5-(1,2,3-triazol-1-yl)benzamide Openeye Name: 2-chloro-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]-5-(triazol-1-yl)benzamide CAS Name: 2-chloro-N-[[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]-5-(1-triazolyl)benzamide IUPAC Name: 2-chloro-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)carbamoyl]-5-(triazol-1-yl)benzamide Traditional Name: 2-chloro-N-[(6-mesyl-1,3-benzothiazol-2-yl)carbamoyl]-5-(triazol-1-yl)benzamide Formula: C18H13ClN6O4S2 MolecularWeight: 476.91662

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)NC(=O)C3=C(C=CC(=C3)N4C=CN=N4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)NC(=O)C3=C(C=CC(=C3)N4C=CN=N4)Cl

InChI

InChI=1S/C18H13ClN6O4S2/c1-31(28,29)11-3-5-14-15(9-11)30-18(21-14)23-17(27)22-16(26)12-8-10(2-4-13(12)19)25-7-6-20-24-25/h2-9H,1H3,(H2,21,22,23,26,27)