2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-prop-2-enyl-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-prop-2-enyl-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-allyl-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]-N-prop-2-enyl-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]-N-prop-2-enyl-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-allyl-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]-N-(2-thenyl)acetamide Formula: C21H26N4O6S2 MolecularWeight: 494.58434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N(CC=C)CC3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)N(CC=C)CC3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O6S2/c1-3-8-23(15-17-5-4-13-32-17)21(26)16-22-9-11-24(12-10-22)33(29,30)18-6-7-20(31-2)19(14-18)25(27)28/h3-7,13-14H,1,8-12,15-16H2,2H3