N-[(3-benzamidophenyl)carbamothioyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-[(3-benzamidophenyl)carbamothioyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-[(3-benzamidophenyl)carbamothioyl]-4-morpholino-3-nitro-benzamide CAS Name: N-[(3-benzamidoanilino)-sulfanylidenemethyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-[(3-benzamidophenyl)carbamothioyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-[(3-benzamidophenyl)thiocarbamoyl]-4-morpholino-3-nitro-benzamide Formula: C25H23N5O5S MolecularWeight: 505.54562

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H23N5O5S/c31-23(17-5-2-1-3-6-17)26-19-7-4-8-20(16-19)27-25(36)28-24(32)18-9-10-21(22(15-18)30(33)34)29-11-13-35-14-12-29/h1-10,15-16H,11-14H2,(H,26,31)(H2,27,28,32,36)