4-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-3-nitro-benzamide

Systemtic Name: 4-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-3-nitro-benzamide Openeye Name: 4-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-3-nitro-benzamide CAS Name: 4-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-3-nitrobenzamide IUPAC Name: 4-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-3-nitrobenzamide Traditional Name: 4-[4-[(5-chloro-2-thienyl)methyl]piperazino]-3-nitro-benzamide Formula: C16H17ClN4O3S MolecularWeight: 380.84918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Cl)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Cl)C3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN4O3S/c17-15-4-2-12(25-15)10-19-5-7-20(8-6-19)13-3-1-11(16(18)22)9-14(13)21(23)24/h1-4,9H,5-8,10H2,(H2,18,22)