4-azanyl-2-butylsulfanyl-6-(dimethylamino)-8-(phenylmethyl)pteridin-7-one

Systemtic Name: 4-azanyl-2-butylsulfanyl-6-(dimethylamino)-8-(phenylmethyl)pteridin-7-one Openeye Name: 4-amino-8-benzyl-2-butylsulfanyl-6-(dimethylamino)pteridin-7-one CAS Name: 4-amino-2-(butylthio)-6-(dimethylamino)-8-(phenylmethyl)-7-pteridinone IUPAC Name: 4-amino-8-benzyl-2-butylsulfanyl-6-(dimethylamino)pteridin-7-one Traditional Name: 4-amino-8-benzyl-2-(butylthio)-6-(dimethylamino)pteridin-7-one Formula: C19H24N6OS MolecularWeight: 384.49846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC2=C(C(=N1)N)N=C(C(=O)N2CC3=CC=CC=C3)N(C)C

Isomeric SMILES

CCCCSC1=NC2=C(C(=N1)N)N=C(C(=O)N2CC3=CC=CC=C3)N(C)C

InChI

InChI=1S/C19H24N6OS/c1-4-5-11-27-19-22-15(20)14-16(23-19)25(12-13-9-7-6-8-10-13)18(26)17(21-14)24(2)3/h6-10H,4-5,11-12H2,1-3H3,(H2,20,22,23)