N-[4-methyl-2,5-bis(oxidanylidene)-4-phenethyl-imidazolidin-1-yl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-methyl-2,5-bis(oxidanylidene)-4-phenethyl-imidazolidin-1-yl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(4-methyl-2,5-dioxo-4-phenethyl-imidazolidin-1-yl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(4-methyl-2,5-dioxo-4-phenethyl-1-imidazolidinyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(4-methyl-2,5-dioxo-4-phenethylimidazolidin-1-yl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(2,5-diketo-4-methyl-4-phenethyl-imidazolidin-1-yl)-5-nitro-benzothiophene-2-carboxamide Formula: C21H18N4O5S MolecularWeight: 438.45642

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])CCC4=CC=CC=C4

Isomeric SMILES

CC1(C(=O)N(C(=O)N1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])CCC4=CC=CC=C4

InChI

InChI=1S/C21H18N4O5S/c1-21(10-9-13-5-3-2-4-6-13)19(27)24(20(28)22-21)23-18(26)17-12-14-11-15(25(29)30)7-8-16(14)31-17/h2-8,11-12H,9-10H2,1H3,(H,22,28)(H,23,26)