4-methyl-3,5-dinitro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]benzamide

Systemtic Name: 4-methyl-3,5-dinitro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]benzamide Openeye Name: 4-methyl-3,5-dinitro-N-[(2-phenylthiazol-4-yl)methyl]benzamide CAS Name: 4-methyl-3,5-dinitro-N-[(2-phenyl-4-thiazolyl)methyl]benzamide IUPAC Name: 4-methyl-3,5-dinitro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]benzamide Traditional Name: 4-methyl-3,5-dinitro-N-[(2-phenylthiazol-4-yl)methyl]benzamide Formula: C18H14N4O5S MolecularWeight: 398.39256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NCC2=CSC(=N2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NCC2=CSC(=N2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N4O5S/c1-11-15(21(24)25)7-13(8-16(11)22(26)27)17(23)19-9-14-10-28-18(20-14)12-5-3-2-4-6-12/h2-8,10H,9H2,1H3,(H,19,23)