3-methyl-N-[(2-morpholin-4-ylphenyl)carbamothioyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[(2-morpholin-4-ylphenyl)carbamothioyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[(2-morpholinophenyl)carbamothioyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[[2-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[(2-morpholin-4-ylphenyl)carbamothioyl]-4-nitrobenzamide Traditional Name: 3-methyl-N-[(2-morpholinophenyl)thiocarbamoyl]-4-nitro-benzamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O4S/c1-13-12-14(6-7-16(13)23(25)26)18(24)21-19(28)20-15-4-2-3-5-17(15)22-8-10-27-11-9-22/h2-7,12H,8-11H2,1H3,(H2,20,21,24,28)