N-[bis(azanyl)methylidene]-2-butyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazine-7-carboxamide dihydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-2-butyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazine-7-carboxamide dihydrochloride Openeye Name: 2-butyl-N-(diaminomethylene)-4-isopropyl-3-oxo-1,4-benzoxazine-7-carboxamide dihydrochloride CAS Name: 2-butyl-N-(diaminomethylidene)-3-oxo-4-propan-2-yl-1,4-benzoxazine-7-carboxamide dihydrochloride IUPAC Name: 2-butyl-N-(diaminomethylidene)-3-oxo-4-propan-2-yl-1,4-benzoxazine-7-carboxamide dihydrochloride Traditional Name: 2-butyl-N-(diaminomethylene)-4-isopropyl-3-keto-1,4-benzoxazine-7-carboxamide dihydrochloride Formula: C17H26Cl2N4O3 MolecularWeight: 405.31934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(C2=C(O1)C=C(C=C2)C(=O)N=C(N)N)C(C)C.Cl.Cl

Isomeric SMILES

CCCCC1C(=O)N(C2=C(O1)C=C(C=C2)C(=O)N=C(N)N)C(C)C.Cl.Cl

InChI

InChI=1S/C17H24N4O3.2ClH/c1-4-5-6-13-16(23)21(10(2)3)12-8-7-11(9-14(12)24-13)15(22)20-17(18)19;;/h7-10,13H,4-6H2,1-3H3,(H4,18,19,20,22);2*1H