3-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide Openeye Name: 3-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide CAS Name: 3-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-N-(4-nitrophenyl)propanamide IUPAC Name: 3-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-N-(4-nitrophenyl)propanamide Traditional Name: 3-[4-[(5-chloro-2-thienyl)methyl]piperazino]-N-(4-nitrophenyl)propionamide Formula: C18H21ClN4O3S MolecularWeight: 408.90234

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CCN1CCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=C(S3)Cl

InChI

InChI=1S/C18H21ClN4O3S/c19-17-6-5-16(27-17)13-22-11-9-21(10-12-22)8-7-18(24)20-14-1-3-15(4-2-14)23(25)26/h1-6H,7-13H2,(H,20,24)