2-[[2-(4-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[[2-(4-methylphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[[5-oxo-2-(p-tolyl)oxazol-4-ylidene]methylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[[2-(4-methylphenyl)-5-oxo-4-oxazolylidene]methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4-ylidene]methylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[[5-keto-2-(p-tolyl)-2-oxazolin-4-ylidene]methylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CNC3=C(C4=C(S3)CCCC4)C#N)C(=O)O2

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CNC3=C(C4=C(S3)CCCC4)C#N)C(=O)O2

InChI

InChI=1S/C20H17N3O2S/c1-12-6-8-13(9-7-12)18-23-16(20(24)25-18)11-22-19-15(10-21)14-4-2-3-5-17(14)26-19/h6-9,11,22H,2-5H2,1H3