5-azanylidene-2-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)thiolan-3-one

Systemtic Name: 5-azanylidene-2-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)thiolan-3-one Openeye Name: 2-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one CAS Name: 2-[(2,5-dimethyl-1-phenyl-3-pyrrolyl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-3-thiolanone IUPAC Name: 2-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-iminothiolan-3-one Traditional Name: 2-[(2,5-dimethyl-1-phenyl-pyrrol-3-yl)methylene]-4-(5-ethyl-1,3,4-thiadiazol-2-yl)-5-imino-tetrahydrothiophen-3-one Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)C2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CC=C4)C)SC2=N

Isomeric SMILES

CCC1=NN=C(S1)C2C(=O)C(=CC3=C(N(C(=C3)C)C4=CC=CC=C4)C)SC2=N

InChI

InChI=1S/C21H20N4OS2/c1-4-17-23-24-21(28-17)18-19(26)16(27-20(18)22)11-14-10-12(2)25(13(14)3)15-8-6-5-7-9-15/h5-11,18,22H,4H2,1-3H3