1,5-dimethyl-4-[(E)-[2-(5-methylthiophen-2-yl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]pyrrole-2-carbonitrile

Systemtic Name: 1,5-dimethyl-4-[(E)-[2-(5-methylthiophen-2-yl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]pyrrole-2-carbonitrile Openeye Name: 1,5-dimethyl-4-[(E)-[2-(5-methyl-2-thienyl)-5-oxo-oxazol-4-ylidene]methyl]pyrrole-2-carbonitrile CAS Name: 1,5-dimethyl-4-[(E)-[2-(5-methyl-2-thiophenyl)-5-oxo-4-oxazolylidene]methyl]-2-pyrrolecarbonitrile IUPAC Name: 1,5-dimethyl-4-[(E)-[2-(5-methylthiophen-2-yl)-5-oxo-1,3-oxazol-4-ylidene]methyl]pyrrole-2-carbonitrile Traditional Name: 4-[(E)-[5-keto-2-(5-methyl-2-thienyl)-2-oxazolin-4-ylidene]methyl]-1,5-dimethyl-pyrrole-2-carbonitrile Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC(=CC3=C(N(C(=C3)C#N)C)C)C(=O)O2

Isomeric SMILES

CC1=CC=C(S1)C2=N/C(=C/C3=C(N(C(=C3)C#N)C)C)/C(=O)O2

InChI

InChI=1S/C16H13N3O2S/c1-9-4-5-14(22-9)15-18-13(16(20)21-15)7-11-6-12(8-17)19(3)10(11)2/h4-7H,1-3H3/b13-7+