1-[2-(2-methyl-4-nitro-phenyl)imino-1,3-thiazolidin-3-yl]butan-2-one

Systemtic Name: 1-[2-(2-methyl-4-nitro-phenyl)imino-1,3-thiazolidin-3-yl]butan-2-one Openeye Name: 1-[2-(2-methyl-4-nitro-phenyl)iminothiazolidin-3-yl]butan-2-one CAS Name: 1-[2-(2-methyl-4-nitrophenyl)imino-3-thiazolidinyl]-2-butanone IUPAC Name: 1-[2-(2-methyl-4-nitrophenyl)imino-1,3-thiazolidin-3-yl]butan-2-one Traditional Name: 1-[2-(2-methyl-4-nitro-phenyl)iminothiazolidin-3-yl]butan-2-one Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CN1CCSC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC(=O)CN1CCSC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H17N3O3S/c1-3-12(18)9-16-6-7-21-14(16)15-13-5-4-11(17(19)20)8-10(13)2/h4-5,8H,3,6-7,9H2,1-2H3