N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-(cyclopropylamino)-3-nitro-benzamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-(cyclopropylamino)-3-nitro-benzamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(cyclopropylamino)-3-nitro-benzamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(cyclopropylamino)-3-nitrobenzamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(cyclopropylamino)-3-nitrobenzamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(cyclopropylamino)-3-nitro-benzamide Formula: C17H13ClN4O3S MolecularWeight: 388.82812

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H13ClN4O3S/c18-10-2-6-13-15(8-10)26-17(20-13)21-16(23)9-1-5-12(19-11-3-4-11)14(7-9)22(24)25/h1-2,5-8,11,19H,3-4H2,(H,20,21,23)