2-[4-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[methyl-[(3-methyl-2-thienyl)methyl]amino]acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-[methyl-[(3-methyl-2-thiophenyl)methyl]amino]-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[methyl-[(3-methylthiophen-2-yl)methyl]amino]acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[methyl-[(3-methyl-2-thienyl)methyl]amino]acetyl]piperazino]sulfonylbenzonitrile Formula: C20H24N4O3S2 MolecularWeight: 432.55956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CC1=C(SC=C1)CN(C)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C20H24N4O3S2/c1-16-7-12-28-18(16)14-22(2)15-20(25)23-8-10-24(11-9-23)29(26,27)19-6-4-3-5-17(19)13-21/h3-7,12H,8-11,14-15H2,1-2H3