5-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(2-chloro-5-morpholinosulfonyl-phenyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(1,3-benzothiazol-2-ylthio)methyl]-1,3,4-thiadiazol-2-yl]-(2-chloro-5-morpholinosulfonyl-phenyl)amine Formula: C20H18ClN5O3S4 MolecularWeight: 540.10162

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC3=NN=C(S3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC3=NN=C(S3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C20H18ClN5O3S4/c21-14-6-5-13(33(27,28)26-7-9-29-10-8-26)11-16(14)22-19-25-24-18(32-19)12-30-20-23-15-3-1-2-4-17(15)31-20/h1-6,11H,7-10,12H2,(H,22,25)