1-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]-3-propan-2-yl-urea

Systemtic Name: 1-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]-3-propan-2-yl-urea Openeye Name: 1-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]-3-isopropyl-urea CAS Name: 1-[[5-cyano-4,6-bis(dimethylamino)-2-pyridin-1-iumyl]amino]-3-propan-2-ylurea IUPAC Name: 1-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]-3-propan-2-ylurea Traditional Name: 1-[[5-cyano-4,6-bis(dimethylamino)pyridin-1-ium-2-yl]amino]-3-isopropyl-urea Formula: C14H24N7O+ MolecularWeight: 306.38666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NNC1=[NH+]C(=C(C(=C1)N(C)C)C#N)N(C)C

Isomeric SMILES

CC(C)NC(=O)NNC1=[NH+]C(=C(C(=C1)N(C)C)C#N)N(C)C

InChI

InChI=1S/C14H23N7O/c1-9(2)16-14(22)19-18-12-7-11(20(3)4)10(8-15)13(17-12)21(5)6/h7,9H,1-6H3,(H,17,18)(H2,16,19,22)/p+1