4-(cyclopropylamino)-2-[[4-(4-methylsulfonylpiperazin-1-yl)phenyl]amino]pyrimidine-5-carboxamide

Systemtic Name: 4-(cyclopropylamino)-2-[[4-(4-methylsulfonylpiperazin-1-yl)phenyl]amino]pyrimidine-5-carboxamide Openeye Name: 4-(cyclopropylamino)-2-[4-(4-methylsulfonylpiperazin-1-yl)anilino]pyrimidine-5-carboxamide CAS Name: 4-(cyclopropylamino)-2-[4-(4-methylsulfonyl-1-piperazinyl)anilino]-5-pyrimidinecarboxamide IUPAC Name: 4-(cyclopropylamino)-2-[4-(4-methylsulfonylpiperazin-1-yl)anilino]pyrimidine-5-carboxamide Traditional Name: 4-(cyclopropylamino)-2-[4-(4-mesylpiperazino)anilino]pyrimidine-5-carboxamide Formula: C19H25N7O3S MolecularWeight: 431.5119

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4CC4)C(=O)N

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C(C(=N3)NC4CC4)C(=O)N

InChI

InChI=1S/C19H25N7O3S/c1-30(28,29)26-10-8-25(9-11-26)15-6-4-14(5-7-15)23-19-21-12-16(17(20)27)18(24-19)22-13-2-3-13/h4-7,12-13H,2-3,8-11H2,1H3,(H2,20,27)(H2,21,22,23,24)