2-[(3-chlorophenyl)amino]-N-(6-nitro-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)amino]-N-(6-nitro-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(3-chloroanilino)-N-(6-nitro-1,3-benzothiazol-2-yl)thiazole-4-carboxamide CAS Name: 2-(3-chloroanilino)-N-(6-nitro-1,3-benzothiazol-2-yl)-4-thiazolecarboxamide IUPAC Name: 2-(3-chloroanilino)-N-(6-nitro-1,3-benzothiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(3-chloroanilino)-N-(6-nitro-1,3-benzothiazol-2-yl)thiazole-4-carboxamide Formula: C17H10ClN5O3S2 MolecularWeight: 431.876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC(=CS2)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC(=CS2)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H10ClN5O3S2/c18-9-2-1-3-10(6-9)19-16-21-13(8-27-16)15(24)22-17-20-12-5-4-11(23(25)26)7-14(12)28-17/h1-8H,(H,19,21)(H,20,22,24)