N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-6-chloro-chromane-3-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-6-chloro-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-6-chloro-chroman-3-carboxamide Formula: C22H29ClN4O4 MolecularWeight: 448.94306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2CC3=C(C=CC(=C3)Cl)OC2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2CC3=C(C=CC(=C3)Cl)OC2)N

InChI

InChI=1S/C22H29ClN4O4/c1-3-5-9-26(18-19(24)27(10-6-4-2)22(30)25-20(18)28)21(29)15-11-14-12-16(23)7-8-17(14)31-13-15/h7-8,12,15H,3-6,9-11,13,24H2,1-2H3,(H,25,28,30)