N-[(4-methyl-3-nitro-phenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[(4-methyl-3-nitro-phenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Openeye Name: N-[(4-methyl-3-nitro-phenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide CAS Name: N-[(4-methyl-3-nitroanilino)-sulfanylidenemethyl]-4-(2-phenoxyethoxy)benzamide IUPAC Name: N-[(4-methyl-3-nitrophenyl)carbamothioyl]-4-(2-phenoxyethoxy)benzamide Traditional Name: N-[(4-methyl-3-nitro-phenyl)thiocarbamoyl]-4-(2-phenoxyethoxy)benzamide Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O5S/c1-16-7-10-18(15-21(16)26(28)29)24-23(32)25-22(27)17-8-11-20(12-9-17)31-14-13-30-19-5-3-2-4-6-19/h2-12,15H,13-14H2,1H3,(H2,24,25,27,32)