4-[methyl-[1-[2-(methylamino)-4-oxidanylidene-1H-pteridin-6-yl]ethyl]amino]-N-propyl-benzamide

Systemtic Name: 4-[methyl-[1-[2-(methylamino)-4-oxidanylidene-1H-pteridin-6-yl]ethyl]amino]-N-propyl-benzamide Openeye Name: 4-[methyl-[1-[2-(methylamino)-4-oxo-1H-pteridin-6-yl]ethyl]amino]-N-propyl-benzamide CAS Name: 4-[methyl-[1-[2-(methylamino)-4-oxo-1H-pteridin-6-yl]ethyl]amino]-N-propylbenzamide IUPAC Name: 4-[methyl-[1-[2-(methylamino)-4-oxo-1H-pteridin-6-yl]ethyl]amino]-N-propylbenzamide Traditional Name: 4-[1-[4-keto-2-(methylamino)-1H-pteridin-6-yl]ethyl-methyl-amino]-N-propyl-benzamide Formula: C20H25N7O2 MolecularWeight: 395.4582

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(C=C1)N(C)C(C)C2=CN=C3C(=N2)C(=O)N=C(N3)NC

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)N(C)C(C)C2=CN=C3C(=N2)C(=O)N=C(N3)NC

InChI

InChI=1S/C20H25N7O2/c1-5-10-22-18(28)13-6-8-14(9-7-13)27(4)12(2)15-11-23-17-16(24-15)19(29)26-20(21-3)25-17/h6-9,11-12H,5,10H2,1-4H3,(H,22,28)(H2,21,23,25,26,29)