N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-[(6-phenyl-4-pyrimidinyl)thio]butanamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(6-phenylpyrimidin-4-yl)sulfanylbutanamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-[(6-phenylpyrimidin-4-yl)thio]butyramide Formula: C23H19N5O3S2 MolecularWeight: 477.55866

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC=NC(=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC=NC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H19N5O3S2/c1-2-20(33-21-12-18(24-14-25-21)15-7-4-3-5-8-15)22(29)27-23-26-19(13-32-23)16-9-6-10-17(11-16)28(30)31/h3-14,20H,2H2,1H3,(H,26,27,29)