N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-3-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-2-benzothiophene-1-carboxamide

Systemtic Name: N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-3-methylsulfanyl-4-oxidanylidene-6,7-dihydro-5H-2-benzothiophene-1-carboxamide Openeye Name: N-[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]-3-methylsulfanyl-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxamide CAS Name: N-[1-[(3,5-dimethyl-4-isoxazolyl)methyl]-4-pyrazolyl]-3-(methylthio)-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxamide IUPAC Name: N-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-3-methylsulfanyl-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxamide Traditional Name: N-[1-[(3,5-dimethylisoxazol-4-yl)methyl]pyrazol-4-yl]-4-keto-3-(methylthio)-6,7-dihydro-5H-isobenzothiophene-1-carboxamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2C=C(C=N2)NC(=O)C3=C4CCCC(=O)C4=C(S3)SC

Isomeric SMILES

CC1=C(C(=NO1)C)CN2C=C(C=N2)NC(=O)C3=C4CCCC(=O)C4=C(S3)SC

InChI

InChI=1S/C19H20N4O3S2/c1-10-14(11(2)26-22-10)9-23-8-12(7-20-23)21-18(25)17-13-5-4-6-15(24)16(13)19(27-3)28-17/h7-8H,4-6,9H2,1-3H3,(H,21,25)