N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(benzotriazol-1-yl)-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-(benzotriazol-1-yl)-N-(furan-2-ylmethyl)ethanamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-2-(benzotriazol-1-yl)-N-(2-furylmethyl)acetamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-2-(1-benzotriazolyl)-N-(2-furanylmethyl)acetamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(benzotriazol-1-yl)-N-(furan-2-ylmethyl)acetamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-2-(benzotriazol-1-yl)-N-(2-furfuryl)acetamide Formula: C21H23N7O4 MolecularWeight: 437.45182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)CN3C4=CC=CC=C4N=N3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC2=CC=CO2)C(=O)CN3C4=CC=CC=C4N=N3)N

InChI

InChI=1S/C21H23N7O4/c1-2-3-10-26-19(22)18(20(30)23-21(26)31)27(12-14-7-6-11-32-14)17(29)13-28-16-9-5-4-8-15(16)24-25-28/h4-9,11H,2-3,10,12-13,22H2,1H3,(H,23,30,31)