3-[(4-chlorophenyl)sulfonylmethyl]-4-pyrrol-1-yl-benzenecarbonitrile

Systemtic Name: 3-[(4-chlorophenyl)sulfonylmethyl]-4-pyrrol-1-yl-benzenecarbonitrile Openeye Name: 3-[(4-chlorophenyl)sulfonylmethyl]-4-pyrrol-1-yl-benzonitrile CAS Name: 3-[(4-chlorophenyl)sulfonylmethyl]-4-(1-pyrrolyl)benzonitrile IUPAC Name: 3-[(4-chlorophenyl)sulfonylmethyl]-4-pyrrol-1-ylbenzonitrile Traditional Name: 3-[(4-chlorophenyl)sulfonylmethyl]-4-pyrrol-1-yl-benzonitrile Formula: C18H13ClN2O2S MolecularWeight: 356.82602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=C(C=C(C=C2)C#N)CS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CN(C=C1)C2=C(C=C(C=C2)C#N)CS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H13ClN2O2S/c19-16-4-6-17(7-5-16)24(22,23)13-15-11-14(12-20)3-8-18(15)21-9-1-2-10-21/h1-11H,13H2