8-nitro-N-phenyl-[1]benzothiolo[3,2-d]pyrimidin-4-amine

Systemtic Name: 8-nitro-N-phenyl-[1]benzothiolo[3,2-d]pyrimidin-4-amine Openeye Name: 8-nitro-N-phenyl-benzothiopheno[3,2-d]pyrimidin-4-amine CAS Name: 8-nitro-N-phenyl-[1]benzothiolo[3,2-d]pyrimidin-4-amine IUPAC Name: 8-nitro-N-phenyl-[1]benzothiolo[3,2-d]pyrimidin-4-amine Traditional Name: (8-nitrobenzothiopheno[3,2-d]pyrimidin-4-yl)-phenyl-amine Formula: C16H10N4O2S MolecularWeight: 322.3412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=NC3=C2SC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=NC3=C2SC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H10N4O2S/c21-20(22)11-6-7-13-12(8-11)14-15(23-13)16(18-9-17-14)19-10-4-2-1-3-5-10/h1-9H,(H,17,18,19)