N-[5-(4-nitrophenyl)sulfanyl-1,3-thiazol-2-yl]propanamide

Systemtic Name: N-[5-(4-nitrophenyl)sulfanyl-1,3-thiazol-2-yl]propanamide Openeye Name: N-[5-(4-nitrophenyl)sulfanylthiazol-2-yl]propanamide CAS Name: N-[5-[(4-nitrophenyl)thio]-2-thiazolyl]propanamide IUPAC Name: N-[5-(4-nitrophenyl)sulfanyl-1,3-thiazol-2-yl]propanamide Traditional Name: N-[5-[(4-nitrophenyl)thio]thiazol-2-yl]propionamide Formula: C12H11N3O3S2 MolecularWeight: 309.36404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC=C(S1)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=NC=C(S1)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H11N3O3S2/c1-2-10(16)14-12-13-7-11(20-12)19-9-5-3-8(4-6-9)15(17)18/h3-7H,2H2,1H3,(H,13,14,16)