4-(2-methyl-5-nitro-phenyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide

Systemtic Name: 4-(2-methyl-5-nitro-phenyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide Openeye Name: N-allyl-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-(2-methyl-5-nitrophenyl)sulfonyl-N-prop-2-enyl-1-piperazinecarbothioamide IUPAC Name: 4-(2-methyl-5-nitrophenyl)sulfonyl-N-prop-2-enylpiperazine-1-carbothioamide Traditional Name: N-allyl-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine-1-carbothioamide Formula: C15H20N4O4S2 MolecularWeight: 384.4737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=S)NCC=C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=S)NCC=C

InChI

InChI=1S/C15H20N4O4S2/c1-3-6-16-15(24)17-7-9-18(10-8-17)25(22,23)14-11-13(19(20)21)5-4-12(14)2/h3-5,11H,1,6-10H2,2H3,(H,16,24)