2,6-bis(chloranyl)-N-oxidanidyl-N-(phenylmethyl)-4-thiomorpholin-4-yl-pteridin-7-amine

Systemtic Name: 2,6-bis(chloranyl)-N-oxidanidyl-N-(phenylmethyl)-4-thiomorpholin-4-yl-pteridin-7-amine Openeye Name: N-benzyl-2,6-dichloro-N-oxido-4-thiomorpholino-pteridin-7-amine CAS Name: 2,6-dichloro-N-oxido-N-(phenylmethyl)-4-thiomorpholin-4-yl-7-pteridinamine IUPAC Name: N-benzyl-2,6-dichloro-N-oxido-4-thiomorpholin-4-ylpteridin-7-amine Traditional Name: benzyl-(2,6-dichloro-4-thiomorpholino-pteridin-7-yl)-oxido-amine Formula: C17H15Cl2N6OS- MolecularWeight: 422.3116

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C2=NC(=NC3=C2N=C(C(=N3)N(CC4=CC=CC=C4)[O-])Cl)Cl

Isomeric SMILES

C1CSCCN1C2=NC(=NC3=C2N=C(C(=N3)N(CC4=CC=CC=C4)[O-])Cl)Cl

InChI

InChI=1S/C17H15Cl2N6OS/c18-13-16(25(26)10-11-4-2-1-3-5-11)21-14-12(20-13)15(23-17(19)22-14)24-6-8-27-9-7-24/h1-5H,6-10H2/q-1