(Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-methylpiperazin-1-yl)thiophen-2-yl]prop-2-enenitrile hydrochloride

Systemtic Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-methylpiperazin-1-yl)thiophen-2-yl]prop-2-enenitrile hydrochloride Openeye Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-methylpiperazin-1-yl)-2-thienyl]prop-2-enenitrile hydrochloride CAS Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-methyl-1-piperazinyl)-2-thiophenyl]-2-propenenitrile hydrochloride IUPAC Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-methylpiperazin-1-yl)thiophen-2-yl]prop-2-enenitrile hydrochloride Traditional Name: (Z)-3-(3,4-dimethoxyphenyl)-3-[5-(4-methylpiperazino)-2-thienyl]acrylonitrile hydrochloride Formula: C20H24ClN3O2S MolecularWeight: 405.94146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(S2)C(=CC#N)C3=CC(=C(C=C3)OC)OC.Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(S2)/C(=C\C#N)/C3=CC(=C(C=C3)OC)OC.Cl

InChI

InChI=1S/C20H23N3O2S.ClH/c1-22-10-12-23(13-11-22)20-7-6-19(26-20)16(8-9-21)15-4-5-17(24-2)18(14-15)25-3;/h4-8,14H,10-13H2,1-3H3;1H/b16-8-;