N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloranyl-4-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloranyl-4-nitro-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloro-4-nitro-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloro-4-nitrobenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloro-4-nitrobenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)ethyl]-2-chloro-4-nitro-benzamide Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCNC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCNC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H12ClN3O3S/c17-12-9-10(20(22)23)5-6-11(12)16(21)18-8-7-15-19-13-3-1-2-4-14(13)24-15/h1-6,9H,7-8H2,(H,18,21)