4,5-bis(4-chlorophenyl)-5-oxidanyl-2-sulfanylidene-1H-pyrrole-3-carbonitrile

Systemtic Name: 4,5-bis(4-chlorophenyl)-5-oxidanyl-2-sulfanylidene-1H-pyrrole-3-carbonitrile Openeye Name: 4,5-bis(4-chlorophenyl)-5-hydroxy-2-thioxo-1H-pyrrole-3-carbonitrile CAS Name: 4,5-bis(4-chlorophenyl)-5-hydroxy-2-sulfanylidene-1H-pyrrole-3-carbonitrile IUPAC Name: 4,5-bis(4-chlorophenyl)-5-hydroxy-2-sulfanylidene-1H-pyrrole-3-carbonitrile Traditional Name: 4,5-bis(4-chlorophenyl)-5-hydroxy-2-thioxo-3-pyrroline-3-carbonitrile Formula: C17H10Cl2N2OS MolecularWeight: 361.2451

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=S)NC2(C3=CC=C(C=C3)Cl)O)C#N)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=S)NC2(C3=CC=C(C=C3)Cl)O)C#N)Cl

InChI

InChI=1S/C17H10Cl2N2OS/c18-12-5-1-10(2-6-12)15-14(9-20)16(23)21-17(15,22)11-3-7-13(19)8-4-11/h1-8,22H,(H,21,23)