2-azanylidene-6-[[(4-chloranyl-2-propan-2-yl-phenyl)amino]methyl]-8-oxidanyl-pteridin-4-amine

Systemtic Name: 2-azanylidene-6-[[(4-chloranyl-2-propan-2-yl-phenyl)amino]methyl]-8-oxidanyl-pteridin-4-amine Openeye Name: 6-[(4-chloro-2-isopropyl-anilino)methyl]-8-hydroxy-2-imino-pteridin-4-amine CAS Name: 6-[(4-chloro-2-propan-2-ylanilino)methyl]-8-hydroxy-2-imino-4-pteridinamine IUPAC Name: 6-[(4-chloro-2-propan-2-ylanilino)methyl]-8-hydroxy-2-iminopteridin-4-amine Traditional Name: (4-amino-8-hydroxy-2-imino-pteridin-6-yl)methyl-(4-chloro-2-isopropyl-phenyl)amine Formula: C16H18ClN7O MolecularWeight: 359.81342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)Cl)NCC2=CN(C3=NC(=N)N=C(C3=N2)N)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)Cl)NCC2=CN(C3=NC(=N)N=C(C3=N2)N)O

InChI

InChI=1S/C16H18ClN7O/c1-8(2)11-5-9(17)3-4-12(11)20-6-10-7-24(25)15-13(21-10)14(18)22-16(19)23-15/h3-5,7-8,20,25H,6H2,1-2H3,(H3,18,19,22)