4-azanyl-N-[4-[(E)-2-(3-nitrophenyl)ethenyl]pyrimidin-2-yl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[4-[(E)-2-(3-nitrophenyl)ethenyl]pyrimidin-2-yl]benzenesulfonamide Openeye Name: 4-amino-N-[4-[(E)-2-(3-nitrophenyl)vinyl]pyrimidin-2-yl]benzenesulfonamide CAS Name: 4-amino-N-[4-[(E)-2-(3-nitrophenyl)ethenyl]-2-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-amino-N-[4-[(E)-2-(3-nitrophenyl)ethenyl]pyrimidin-2-yl]benzenesulfonamide Traditional Name: 4-amino-N-[4-[(E)-2-(3-nitrophenyl)vinyl]pyrimidin-2-yl]benzenesulfonamide Formula: C18H15N5O4S MolecularWeight: 397.4078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC2=NC(=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C2=NC(=NC=C2)NS(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C18H15N5O4S/c19-14-5-8-17(9-6-14)28(26,27)22-18-20-11-10-15(21-18)7-4-13-2-1-3-16(12-13)23(24)25/h1-12H,19H2,(H,20,21,22)/b7-4+