1-[2-azanyl-4-(3-methylbut-2-enylamino)pyrimidin-5-yl]sulfonyl-3-propan-2-yl-urea

Systemtic Name: 1-[2-azanyl-4-(3-methylbut-2-enylamino)pyrimidin-5-yl]sulfonyl-3-propan-2-yl-urea Openeye Name: 1-[2-amino-4-(3-methylbut-2-enylamino)pyrimidin-5-yl]sulfonyl-3-isopropyl-urea CAS Name: 1-[[2-amino-4-(3-methylbut-2-enylamino)-5-pyrimidinyl]sulfonyl]-3-propan-2-ylurea IUPAC Name: 1-[2-amino-4-(3-methylbut-2-enylamino)pyrimidin-5-yl]sulfonyl-3-propan-2-ylurea Traditional Name: 1-[2-amino-4-(3-methylbut-2-enylamino)pyrimidin-5-yl]sulfonyl-3-isopropyl-urea Formula: C13H22N6O3S MolecularWeight: 342.41718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NS(=O)(=O)C1=CN=C(N=C1NCC=C(C)C)N

Isomeric SMILES

CC(C)NC(=O)NS(=O)(=O)C1=CN=C(N=C1NCC=C(C)C)N

InChI

InChI=1S/C13H22N6O3S/c1-8(2)5-6-15-11-10(7-16-12(14)18-11)23(21,22)19-13(20)17-9(3)4/h5,7,9H,6H2,1-4H3,(H2,17,19,20)(H3,14,15,16,18)