2-azanylidene-6-[[[3,4-bis(chloranyl)-2-methyl-phenyl]amino]methyl]-8-oxidanyl-pteridin-4-amine

Systemtic Name: 2-azanylidene-6-[[[3,4-bis(chloranyl)-2-methyl-phenyl]amino]methyl]-8-oxidanyl-pteridin-4-amine Openeye Name: 6-[(3,4-dichloro-2-methyl-anilino)methyl]-8-hydroxy-2-imino-pteridin-4-amine CAS Name: 6-[(3,4-dichloro-2-methylanilino)methyl]-8-hydroxy-2-imino-4-pteridinamine IUPAC Name: 6-[(3,4-dichloro-2-methylanilino)methyl]-8-hydroxy-2-iminopteridin-4-amine Traditional Name: (4-amino-8-hydroxy-2-imino-pteridin-6-yl)methyl-(3,4-dichloro-2-methyl-phenyl)amine Formula: C14H13Cl2N7O MolecularWeight: 366.20532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)Cl)NCC2=CN(C3=NC(=N)N=C(C3=N2)N)O

Isomeric SMILES

CC1=C(C=CC(=C1Cl)Cl)NCC2=CN(C3=NC(=N)N=C(C3=N2)N)O

InChI

InChI=1S/C14H13Cl2N7O/c1-6-9(3-2-8(15)10(6)16)19-4-7-5-23(24)13-11(20-7)12(17)21-14(18)22-13/h2-3,5,19,24H,4H2,1H3,(H3,17,18,21)