[4-[4-(5-nitrothiophen-2-yl)sulfanylbutyl]piperazin-1-yl]-(4-phenyl-1H-pyrrol-2-yl)methanone

Systemtic Name: [4-[4-(5-nitrothiophen-2-yl)sulfanylbutyl]piperazin-1-yl]-(4-phenyl-1H-pyrrol-2-yl)methanone Openeye Name: [4-[4-[(5-nitro-2-thienyl)sulfanyl]butyl]piperazin-1-yl]-(4-phenyl-1H-pyrrol-2-yl)methanone CAS Name: [4-[4-[(5-nitro-2-thiophenyl)thio]butyl]-1-piperazinyl]-(4-phenyl-1H-pyrrol-2-yl)methanone IUPAC Name: [4-[4-(5-nitrothiophen-2-yl)sulfanylbutyl]piperazin-1-yl]-(4-phenyl-1H-pyrrol-2-yl)methanone Traditional Name: [4-[4-[(5-nitro-2-thienyl)thio]butyl]piperazino]-(4-phenyl-1H-pyrrol-2-yl)methanone Formula: C23H26N4O3S2 MolecularWeight: 470.60754

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCSC2=CC=C(S2)[N+](=O)[O-])C(=O)C3=CC(=CN3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCCSC2=CC=C(S2)[N+](=O)[O-])C(=O)C3=CC(=CN3)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3S2/c28-23(20-16-19(17-24-20)18-6-2-1-3-7-18)26-13-11-25(12-14-26)10-4-5-15-31-22-9-8-21(32-22)27(29)30/h1-3,6-9,16-17,24H,4-5,10-15H2