2-azanylidene-6-[[(3,4-dichlorophenyl)-propyl-amino]methyl]-8-oxidanyl-pteridin-4-amine

Systemtic Name: 2-azanylidene-6-[[(3,4-dichlorophenyl)-propyl-amino]methyl]-8-oxidanyl-pteridin-4-amine Openeye Name: 6-[(3,4-dichloro-N-propyl-anilino)methyl]-8-hydroxy-2-imino-pteridin-4-amine CAS Name: 6-[(3,4-dichloro-N-propylanilino)methyl]-8-hydroxy-2-imino-4-pteridinamine IUPAC Name: 6-[(3,4-dichloro-N-propylanilino)methyl]-8-hydroxy-2-iminopteridin-4-amine Traditional Name: (4-amino-8-hydroxy-2-imino-pteridin-6-yl)methyl-(3,4-dichlorophenyl)-propyl-amine Formula: C16H17Cl2N7O MolecularWeight: 394.25848

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CN(C2=NC(=N)N=C(C2=N1)N)O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCN(CC1=CN(C2=NC(=N)N=C(C2=N1)N)O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H17Cl2N7O/c1-2-5-24(10-3-4-11(17)12(18)6-10)7-9-8-25(26)15-13(21-9)14(19)22-16(20)23-15/h3-4,6,8,26H,2,5,7H2,1H3,(H3,19,20,22)