(3-methyl-4-nitro-phenyl)-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3-methyl-4-nitro-phenyl)-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Openeye Name: (3-methyl-4-nitro-phenyl)-[4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]methanone CAS Name: (3-methyl-4-nitrophenyl)-[4-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]methanone IUPAC Name: (3-methyl-4-nitrophenyl)-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Traditional Name: (3-methyl-4-nitro-phenyl)-[4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazino]methanone Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CSC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CSC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4S/c1-13-10-14(2-3-16(13)24(26)27)19(25)23-7-5-22(6-8-23)11-17-20-18(21-28-17)15-4-9-29-12-15/h2-4,9-10,12H,5-8,11H2,1H3