N-(2-chloranyl-4-nitro-phenyl)-2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]propanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]propanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]propanamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]propanamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[4-[(5-chloro-2-thienyl)methyl]piperazino]propionamide Formula: C18H20Cl2N4O3S MolecularWeight: 443.3474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCN(CC2)CC3=CC=C(S3)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl)N2CCN(CC2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C18H20Cl2N4O3S/c1-12(18(25)21-16-4-2-13(24(26)27)10-15(16)19)23-8-6-22(7-9-23)11-14-3-5-17(20)28-14/h2-5,10,12H,6-9,11H2,1H3,(H,21,25)