1-(2-methoxy-5-nitro-phenyl)-3-propan-2-yl-thiourea

Systemtic Name: 1-(2-methoxy-5-nitro-phenyl)-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-(2-methoxy-5-nitro-phenyl)thiourea CAS Name: 1-(2-methoxy-5-nitrophenyl)-3-propan-2-ylthiourea IUPAC Name: 1-(2-methoxy-5-nitrophenyl)-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-(2-methoxy-5-nitro-phenyl)thiourea Formula: C11H15N3O3S MolecularWeight: 269.3201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)NC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C11H15N3O3S/c1-7(2)12-11(18)13-9-6-8(14(15)16)4-5-10(9)17-3/h4-7H,1-3H3,(H2,12,13,18)