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

Systemtic Name: 2-[[4-methyl-5-(phenylmethyl)-1,3-thiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)ethanamide Openeye Name: 2-(5-benzyl-4-methyl-thiazol-2-yl)sulfanyl-N-(4-nitrophenyl)acetamide CAS Name: 2-[[4-methyl-5-(phenylmethyl)-2-thiazolyl]thio]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[(5-benzyl-4-methyl-1,3-thiazol-2-yl)sulfanyl]-N-(4-nitrophenyl)acetamide Traditional Name: 2-[(5-benzyl-4-methyl-thiazol-2-yl)thio]-N-(4-nitrophenyl)acetamide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=N1)SCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H17N3O3S2/c1-13-17(11-14-5-3-2-4-6-14)27-19(20-13)26-12-18(23)21-15-7-9-16(10-8-15)22(24)25/h2-10H,11-12H2,1H3,(H,21,23)