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

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

Systemtic Name:3-(3-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide
Openeye Name:3-(3-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide
CAS Name:3-(3-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide
IUPAC Name:3-(3-chlorophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide
Traditional Name:3-(3-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(=C1)Cl)CCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


Isomeric SMILES

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


InChI

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


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