3-(4-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(4-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(4-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(4-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(4-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(4-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propionamide Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl

InChI

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