1-cyclopentyl-3-[2-(4-nitrophenyl)sulfanylethanoylamino]thiourea

Systemtic Name: 1-cyclopentyl-3-[2-(4-nitrophenyl)sulfanylethanoylamino]thiourea Openeye Name: 1-cyclopentyl-3-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[2-[(4-nitrophenyl)thio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[2-(4-nitrophenyl)sulfanylacetyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[[2-[(4-nitrophenyl)thio]acetyl]amino]thiourea Formula: C14H18N4O3S2 MolecularWeight: 354.44772

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)NC(=S)NNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O3S2/c19-13(16-17-14(22)15-10-3-1-2-4-10)9-23-12-7-5-11(6-8-12)18(20)21/h5-8,10H,1-4,9H2,(H,16,19)(H2,15,17,22)