(4S)-4-(1,3-benzothiazol-2-ylamino)-2-methyl-5-oxidanylidene-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile

Systemtic Name: (4S)-4-(1,3-benzothiazol-2-ylamino)-2-methyl-5-oxidanylidene-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile Openeye Name: (4S)-4-(1,3-benzothiazol-2-ylamino)-2-methyl-5-oxo-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile CAS Name: (4S)-4-(1,3-benzothiazol-2-ylamino)-2-methyl-5-oxo-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile IUPAC Name: (4S)-4-(1,3-benzothiazol-2-ylamino)-2-methyl-5-oxo-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile Traditional Name: (4S)-4-(1,3-benzothiazol-2-ylamino)-5-keto-2-methyl-4-(trifluoromethyl)-2-pyrroline-3-carbonitrile Formula: C14H9F3N4OS MolecularWeight: 338.30767

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1)(C(F)(F)F)NC2=NC3=CC=CC=C3S2)C#N

Isomeric SMILES

CC1=C([C@](C(=O)N1)(C(F)(F)F)NC2=NC3=CC=CC=C3S2)C#N

InChI

InChI=1S/C14H9F3N4OS/c1-7-8(6-18)13(11(22)19-7,14(15,16)17)21-12-20-9-4-2-3-5-10(9)23-12/h2-5H,1H3,(H,19,22)(H,20,21)/t13-/m0/s1