4-chloranyl-N-[[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-N-[[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]carbamothioyl]benzamide Openeye Name: 4-chloro-N-[[5-(4-nitrophenyl)sulfonylthiazol-2-yl]carbamothioyl]benzamide CAS Name: 4-chloro-N-[[[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(5-nosylthiazol-2-yl)thiocarbamoyl]benzamide Formula: C17H11ClN4O5S3 MolecularWeight: 482.94104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=S)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=S)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11ClN4O5S3/c18-11-3-1-10(2-4-11)15(23)20-16(28)21-17-19-9-14(29-17)30(26,27)13-7-5-12(6-8-13)22(24)25/h1-9H,(H2,19,20,21,23,28)