3-(4-morpholin-4-ylsulfonylphenyl)-N-(1,3-thiazol-2-ylcarbamothioyl)prop-2-enamide

Systemtic Name: 3-(4-morpholin-4-ylsulfonylphenyl)-N-(1,3-thiazol-2-ylcarbamothioyl)prop-2-enamide Openeye Name: 3-(4-morpholinosulfonylphenyl)-N-(thiazol-2-ylcarbamothioyl)prop-2-enamide CAS Name: 3-[4-(4-morpholinylsulfonyl)phenyl]-N-[sulfanylidene-(2-thiazolylamino)methyl]-2-propenamide IUPAC Name: 3-(4-morpholin-4-ylsulfonylphenyl)-N-(1,3-thiazol-2-ylcarbamothioyl)prop-2-enamide Traditional Name: 3-(4-morpholinosulfonylphenyl)-N-(thiazol-2-ylthiocarbamoyl)acrylamide Formula: C17H18N4O4S3 MolecularWeight: 438.54422

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)NC(=S)NC3=NC=CS3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)NC(=S)NC3=NC=CS3

InChI

InChI=1S/C17H18N4O4S3/c22-15(19-16(26)20-17-18-7-12-27-17)6-3-13-1-4-14(5-2-13)28(23,24)21-8-10-25-11-9-21/h1-7,12H,8-11H2,(H2,18,19,20,22,26)