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

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-[(6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-[(6-phenylpyrimidin-4-yl)thio]propionamide Formula: C22H17N5O3S2 MolecularWeight: 463.53208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N5O3S2/c1-14(32-20-11-18(23-13-24-20)15-6-3-2-4-7-15)21(28)26-22-25-19(12-31-22)16-8-5-9-17(10-16)27(29)30/h2-14H,1H3,(H,25,26,28)