N-(2,3-dihydro-1H-inden-5-yl)-2-[(2-methoxy-5-nitro-phenyl)carbamothioylamino]-2-thiophen-3-yl-ethanamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[(2-methoxy-5-nitro-phenyl)carbamothioylamino]-2-thiophen-3-yl-ethanamide Openeye Name: N-indan-5-yl-2-[(2-methoxy-5-nitro-phenyl)carbamothioylamino]-2-(3-thienyl)acetamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[[(2-methoxy-5-nitroanilino)-sulfanylidenemethyl]amino]-2-(3-thiophenyl)acetamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[(2-methoxy-5-nitrophenyl)carbamothioylamino]-2-thiophen-3-ylacetamide Traditional Name: N-indan-5-yl-2-[(2-methoxy-5-nitro-phenyl)thiocarbamoylamino]-2-(3-thienyl)acetamide Formula: C23H22N4O4S2 MolecularWeight: 482.57518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(C2=CSC=C2)C(=O)NC3=CC4=C(CCC4)C=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(C2=CSC=C2)C(=O)NC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C23H22N4O4S2/c1-31-20-8-7-18(27(29)30)12-19(20)25-23(32)26-21(16-9-10-33-13-16)22(28)24-17-6-5-14-3-2-4-15(14)11-17/h5-13,21H,2-4H2,1H3,(H,24,28)(H2,25,26,32)