N-(3-azanylpropyl)-4-methyl-N-[2-methyl-1-[4-oxidanylidene-3-(phenylmethyl)pteridin-2-yl]propyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-4-methyl-N-[2-methyl-1-[4-oxidanylidene-3-(phenylmethyl)pteridin-2-yl]propyl]benzamide Openeye Name: N-(3-aminopropyl)-N-[1-(3-benzyl-4-oxo-pteridin-2-yl)-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-(3-aminopropyl)-4-methyl-N-[2-methyl-1-[4-oxo-3-(phenylmethyl)-2-pteridinyl]propyl]benzamide IUPAC Name: N-(3-aminopropyl)-N-[1-(3-benzyl-4-oxopteridin-2-yl)-2-methylpropyl]-4-methylbenzamide Traditional Name: N-(3-aminopropyl)-N-[1-(3-benzyl-4-keto-pteridin-2-yl)-2-methyl-propyl]-4-methyl-benzamide Formula: C28H32N6O2 MolecularWeight: 484.59268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NC3=NC=CN=C3C(=O)N2CC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CCCN)C(C2=NC3=NC=CN=C3C(=O)N2CC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C28H32N6O2/c1-19(2)24(33(17-7-14-29)27(35)22-12-10-20(3)11-13-22)26-32-25-23(30-15-16-31-25)28(36)34(26)18-21-8-5-4-6-9-21/h4-6,8-13,15-16,19,24H,7,14,17-18,29H2,1-3H3