5-[(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-allyl-5-[(3-nitro-4-pyrimidin-2-ylsulfanyl-phenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: 5-[[3-nitro-4-(2-pyrimidinylthio)phenyl]methylidene]-3-prop-2-enyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[(3-nitro-4-pyrimidin-2-ylsulfanylphenyl)methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-allyl-5-[3-nitro-4-(2-pyrimidylthio)benzylidene]-2-thioxo-thiazolidin-4-one Formula: C17H12N4O3S3 MolecularWeight: 416.49718

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC(=C(C=C2)SC3=NC=CC=N3)[N+](=O)[O-])SC1=S

Isomeric SMILES

C=CCN1C(=O)C(=CC2=CC(=C(C=C2)SC3=NC=CC=N3)[N+](=O)[O-])SC1=S

InChI

InChI=1S/C17H12N4O3S3/c1-2-8-20-15(22)14(27-17(20)25)10-11-4-5-13(12(9-11)21(23)24)26-16-18-6-3-7-19-16/h2-7,9-10H,1,8H2