4-(cyclopropylamino)-3-nitro-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]benzamide

Systemtic Name: 4-(cyclopropylamino)-3-nitro-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]benzamide Openeye Name: 4-(cyclopropylamino)-3-nitro-N-[3-(2-thioxo-1H-imidazol-3-yl)phenyl]benzamide CAS Name: 4-(cyclopropylamino)-3-nitro-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]benzamide IUPAC Name: 4-(cyclopropylamino)-3-nitro-N-[3-(2-sulfanylidene-1H-imidazol-3-yl)phenyl]benzamide Traditional Name: 4-(cyclopropylamino)-3-nitro-N-[3-(2-thioxo-4-imidazolin-1-yl)phenyl]benzamide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)N4C=CNC4=S)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)N4C=CNC4=S)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O3S/c25-18(12-4-7-16(21-13-5-6-13)17(10-12)24(26)27)22-14-2-1-3-15(11-14)23-9-8-20-19(23)28/h1-4,7-11,13,21H,5-6H2,(H,20,28)(H,22,25)