4-[(2-methylsulfonylphenyl)-(propylamino)amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-[(2-methylsulfonylphenyl)-(propylamino)amino]pyrimidine-5-carbonitrile Openeye Name: 4-[2-methylsulfonyl-N-(propylamino)anilino]pyrimidine-5-carbonitrile CAS Name: 4-[2-methylsulfonyl-N-(propylamino)anilino]-5-pyrimidinecarbonitrile IUPAC Name: 4-[2-methylsulfonyl-N-(propylamino)anilino]pyrimidine-5-carbonitrile Traditional Name: 4-[2-mesyl-N-(propylamino)anilino]pyrimidine-5-carbonitrile Formula: C15H17N5O2S MolecularWeight: 331.39278

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Descriptors Computed from Structure

Canonical SMILES:

CCCNN(C1=CC=CC=C1S(=O)(=O)C)C2=NC=NC=C2C#N

Isomeric SMILES

CCCNN(C1=CC=CC=C1S(=O)(=O)C)C2=NC=NC=C2C#N

InChI

InChI=1S/C15H17N5O2S/c1-3-8-19-20(15-12(9-16)10-17-11-18-15)13-6-4-5-7-14(13)23(2,21)22/h4-7,10-11,19H,3,8H2,1-2H3