2-[4-[2-[cyclopropyl(1-cyclopropylethyl)amino]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-[cyclopropyl(1-cyclopropylethyl)amino]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-[cyclopropyl(1-cyclopropylethyl)amino]acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-[cyclopropyl(1-cyclopropylethyl)amino]-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-[cyclopropyl(1-cyclopropylethyl)amino]acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-[cyclopropyl(1-cyclopropylethyl)amino]acetyl]piperazino]sulfonylbenzonitrile Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)N(CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C4CC4

Isomeric SMILES

CC(C1CC1)N(CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N)C4CC4

InChI

InChI=1S/C21H28N4O3S/c1-16(17-6-7-17)25(19-8-9-19)15-21(26)23-10-12-24(13-11-23)29(27,28)20-5-3-2-4-18(20)14-22/h2-5,16-17,19H,6-13,15H2,1H3