N-[2-[2-[(2,4-dichlorophenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[2-[2-[(2,4-dichlorophenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[2-[2-[(2,4-dichlorophenyl)carbamothioyl]hydrazino]-2-oxo-ethyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[2-[[(2,4-dichloroanilino)-sulfanylidenemethyl]hydrazo]-2-oxoethyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[2-[2-[(2,4-dichlorophenyl)carbamothioyl]hydrazinyl]-2-oxoethyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[2-[N'-[(2,4-dichlorophenyl)thiocarbamoyl]hydrazino]-2-keto-ethyl]-4-methoxy-3-nitro-benzamide Formula: C17H15Cl2N5O5S MolecularWeight: 472.3025

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)NNC(=S)NC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)NNC(=S)NC2=C(C=C(C=C2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H15Cl2N5O5S/c1-29-14-5-2-9(6-13(14)24(27)28)16(26)20-8-15(25)22-23-17(30)21-12-4-3-10(18)7-11(12)19/h2-7H,8H2,1H3,(H,20,26)(H,22,25)(H2,21,23,30)