N-[2-[(2-methoxyphenyl)carbamothioylamino]cyclopentyl]-N-methyl-2-nitro-benzamide

Systemtic Name: N-[2-[(2-methoxyphenyl)carbamothioylamino]cyclopentyl]-N-methyl-2-nitro-benzamide Openeye Name: N-[2-[(2-methoxyphenyl)carbamothioylamino]cyclopentyl]-N-methyl-2-nitro-benzamide CAS Name: N-[2-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]cyclopentyl]-N-methyl-2-nitrobenzamide IUPAC Name: N-[2-[(2-methoxyphenyl)carbamothioylamino]cyclopentyl]-N-methyl-2-nitrobenzamide Traditional Name: N-[2-[(2-methoxyphenyl)thiocarbamoylamino]cyclopentyl]-N-methyl-2-nitro-benzamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC1NC(=S)NC2=CC=CC=C2OC)C(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCC1NC(=S)NC2=CC=CC=C2OC)C(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O4S/c1-24(20(26)14-8-3-5-11-17(14)25(27)28)18-12-7-10-15(18)22-21(30)23-16-9-4-6-13-19(16)29-2/h3-6,8-9,11,13,15,18H,7,10,12H2,1-2H3,(H2,22,23,30)