2-[4-[2-[(2S)-2-methylmorpholin-4-yl]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-[(2S)-2-methylmorpholin-4-yl]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[(2S)-2-methylmorpholin-4-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-[(2S)-2-methyl-4-morpholinyl]-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[(2S)-2-methylmorpholin-4-yl]acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[(2S)-2-methylmorpholino]acetyl]piperazino]sulfonylbenzonitrile Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C[C@H]1CN(CCO1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C18H24N4O4S/c1-15-13-20(10-11-26-15)14-18(23)21-6-8-22(9-7-21)27(24,25)17-5-3-2-4-16(17)12-19/h2-5,15H,6-11,13-14H2,1H3/t15-/m0/s1