5-azanyl-2-(4-propan-2-ylpiperazin-1-yl)sulfonyl-benzenecarbonitrile

Systemtic Name: 5-azanyl-2-(4-propan-2-ylpiperazin-1-yl)sulfonyl-benzenecarbonitrile Openeye Name: 5-amino-2-(4-isopropylpiperazin-1-yl)sulfonyl-benzonitrile CAS Name: 5-amino-2-[(4-propan-2-yl-1-piperazinyl)sulfonyl]benzonitrile IUPAC Name: 5-amino-2-(4-propan-2-ylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 5-amino-2-(4-isopropylpiperazino)sulfonyl-benzonitrile Formula: C14H20N4O2S MolecularWeight: 308.3992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)N)C#N

Isomeric SMILES

CC(C)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)N)C#N

InChI

InChI=1S/C14H20N4O2S/c1-11(2)17-5-7-18(8-6-17)21(19,20)14-4-3-13(16)9-12(14)10-15/h3-4,9,11H,5-8,16H2,1-2H3