4-methylsulfanyl-3-nitro-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-methylsulfanyl-3-nitro-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]benzamide Openeye Name: N-(5-benzylthiazol-2-yl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: 4-(methylthio)-3-nitro-N-[5-(phenylmethyl)-2-thiazolyl]benzamide IUPAC Name: N-(5-benzyl-1,3-thiazol-2-yl)-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-(5-benzylthiazol-2-yl)-4-(methylthio)-3-nitro-benzamide Formula: C18H15N3O3S2 MolecularWeight: 385.46

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NC2=NC=C(S2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NC2=NC=C(S2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3S2/c1-25-16-8-7-13(10-15(16)21(23)24)17(22)20-18-19-11-14(26-18)9-12-5-3-2-4-6-12/h2-8,10-11H,9H2,1H3,(H,19,20,22)