4-[3-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzenecarbonitrile

Systemtic Name: 4-[3-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxidanylidene-propyl]benzenecarbonitrile Openeye Name: 4-[3-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]-3-oxo-propyl]benzonitrile CAS Name: 4-[3-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]-3-oxopropyl]benzonitrile IUPAC Name: 4-[3-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]-3-oxopropyl]benzonitrile Traditional Name: 4-[3-keto-3-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]propyl]benzonitrile Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H21N3O3S2/c1-15-2-9-19(26-15)27(24,25)22-12-10-21(11-13-22)18(23)8-7-16-3-5-17(14-20)6-4-16/h2-6,9H,7-8,10-13H2,1H3