1-[(Z)-1-(4-chloranyl-3-nitro-phenyl)ethylideneamino]-3-[(2R)-1-methoxypropan-2-yl]thiourea

Systemtic Name: 1-[(Z)-1-(4-chloranyl-3-nitro-phenyl)ethylideneamino]-3-[(2R)-1-methoxypropan-2-yl]thiourea Openeye Name: 1-[(Z)-1-(4-chloro-3-nitro-phenyl)ethylideneamino]-3-[(1R)-2-methoxy-1-methyl-ethyl]thiourea CAS Name: 1-[(Z)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-3-[(2R)-1-methoxypropan-2-yl]thiourea IUPAC Name: 1-[(Z)-1-(4-chloro-3-nitrophenyl)ethylideneamino]-3-[(2R)-1-methoxypropan-2-yl]thiourea Traditional Name: 1-[(Z)-1-(4-chloro-3-nitro-phenyl)ethylideneamino]-3-[(1R)-2-methoxy-1-methyl-ethyl]thiourea Formula: C13H17ClN4O3S MolecularWeight: 344.81708

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=S)NN=C(C)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@H](COC)NC(=S)N/N=C(/C)\C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H17ClN4O3S/c1-8(7-21-3)15-13(22)17-16-9(2)10-4-5-11(14)12(6-10)18(19)20/h4-6,8H,7H2,1-3H3,(H2,15,17,22)/b16-9-/t8-/m1/s1