1-[(4-methyl-3-nitro-phenyl)carbonylamino]-3-[[(2S)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-[(4-methyl-3-nitro-phenyl)carbonylamino]-3-[[(2S)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-[(4-methyl-3-nitro-benzoyl)amino]-3-[[(2S)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-[[(4-methyl-3-nitrophenyl)-oxomethyl]amino]-3-[[(2S)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-[(4-methyl-3-nitrobenzoyl)amino]-3-[[(2S)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-[(4-methyl-3-nitro-benzoyl)amino]-3-[[(2S)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C14H18N4O4S MolecularWeight: 338.38212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NNC(=S)NCC2CCCO2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NNC(=S)NC[C@@H]2CCCO2)[N+](=O)[O-]

InChI

InChI=1S/C14H18N4O4S/c1-9-4-5-10(7-12(9)18(20)21)13(19)16-17-14(23)15-8-11-3-2-6-22-11/h4-5,7,11H,2-3,6,8H2,1H3,(H,16,19)(H2,15,17,23)/t11-/m0/s1