(3E)-3-[4-(4-chlorophenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]naphthalen-2-one

Systemtic Name: (3E)-3-[4-(4-chlorophenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]naphthalen-2-one Openeye Name: (3E)-3-[4-(4-chlorophenyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]naphthalen-2-one CAS Name: (3E)-3-[4-(4-chlorophenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-2-naphthalenone IUPAC Name: (3E)-3-[4-(4-chlorophenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]naphthalen-2-one Traditional Name: (3E)-3-[4-(4-chlorophenyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]naphthalen-2-one Formula: C18H12ClN3OS MolecularWeight: 353.82538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=C3NNC(=S)N3C4=CC=C(C=C4)Cl)C(=O)C=C2C=C1

Isomeric SMILES

C1=CC2=C/C(=C/3\NNC(=S)N3C4=CC=C(C=C4)Cl)/C(=O)C=C2C=C1

InChI

InChI=1S/C18H12ClN3OS/c19-13-5-7-14(8-6-13)22-17(20-21-18(22)24)15-9-11-3-1-2-4-12(11)10-16(15)23/h1-10,20H,(H,21,24)/b17-15-