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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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