4-[4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-4-oxo-butoxy]-3-methoxy-benzonitrile CAS Name: 4-[4-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-4-oxobutoxy]-3-methoxybenzonitrile IUPAC Name: 4-[4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-4-oxobutoxy]-3-methoxybenzonitrile Traditional Name: 4-[4-keto-4-(4-p-phenetylsulfonylpiperazino)butoxy]-3-methoxy-benzonitrile Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCOC3=C(C=C(C=C3)C#N)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCOC3=C(C=C(C=C3)C#N)OC

InChI

InChI=1S/C24H29N3O6S/c1-3-32-20-7-9-21(10-8-20)34(29,30)27-14-12-26(13-15-27)24(28)5-4-16-33-22-11-6-19(18-25)17-23(22)31-2/h6-11,17H,3-5,12-16H2,1-2H3