N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-2-(1,2-benzoxazol-3-yl)-N-butyl-ethanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-2-(1,2-benzoxazol-3-yl)-N-butyl-ethanamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-2-(1,2-benzoxazol-3-yl)-N-butyl-acetamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-2-(1,2-benzoxazol-3-yl)-N-butylacetamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-2-(1,2-benzoxazol-3-yl)-N-butylacetamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-2-indoxazen-3-yl-acetamide Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CC2=NOC3=CC=CC=C32

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CC2=NOC3=CC=CC=C32

InChI

InChI=1S/C20H25N5O4/c1-3-5-11-24(17-18(21)25(10-4-2)20(28)22-19(17)27)16(26)12-14-13-8-6-7-9-15(13)29-23-14/h6-9H,3-5,10-12,21H2,1-2H3,(H,22,27,28)