(5E)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-5-pyrrol-2-ylidene-4H-1,3,4-thiadiazin-2-amine

Systemtic Name: (5E)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-5-pyrrol-2-ylidene-4H-1,3,4-thiadiazin-2-amine Openeye Name: (5E)-N-(2-chloro-5-morpholinosulfonyl-phenyl)-5-pyrrol-2-ylidene-4H-1,3,4-thiadiazin-2-amine CAS Name: (5E)-N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-5-(2-pyrrolylidene)-4H-1,3,4-thiadiazin-2-amine IUPAC Name: (5E)-N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-5-pyrrol-2-ylidene-4H-1,3,4-thiadiazin-2-amine Traditional Name: (2-chloro-5-morpholinosulfonyl-phenyl)-[(5E)-5-pyrrol-2-ylidene-4H-1,3,4-thiadiazin-2-yl]amine Formula: C17H18ClN5O3S2 MolecularWeight: 439.93952

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC3=NNC(=C4C=CC=N4)CS3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)Cl)NC3=NN/C(=C/4\C=CC=N4)/CS3

InChI

InChI=1S/C17H18ClN5O3S2/c18-13-4-3-12(28(24,25)23-6-8-26-9-7-23)10-15(13)20-17-22-21-16(11-27-17)14-2-1-5-19-14/h1-5,10,21H,6-9,11H2,(H,20,22)/b16-14+