2-cyano-3-[[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]carbamothioylamino]prop-2-enamide

Systemtic Name: 2-cyano-3-[[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]carbamothioylamino]prop-2-enamide Openeye Name: 2-cyano-3-[[4-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]phenyl]carbamothioylamino]prop-2-enamide CAS Name: 2-cyano-3-[[[4-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]anilino]-sulfanylidenemethyl]amino]-2-propenamide IUPAC Name: 2-cyano-3-[[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]carbamothioylamino]prop-2-enamide Traditional Name: 2-cyano-3-[[4-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]phenyl]thiocarbamoylamino]acrylamide Formula: C16H16N6O4S2 MolecularWeight: 420.46604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC=C(C#N)C(=O)N

Isomeric SMILES

CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC=C(C#N)C(=O)N

InChI

InChI=1S/C16H16N6O4S2/c1-9-10(2)21-26-15(9)22-28(24,25)13-5-3-12(4-6-13)20-16(27)19-8-11(7-17)14(18)23/h3-6,8,22H,1-2H3,(H2,18,23)(H2,19,20,27)