1-ethyl-1-(2-methylprop-2-enyl)-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-ethyl-1-(2-methylprop-2-enyl)-3-(4-nitrophenyl)thiourea Openeye Name: 1-ethyl-1-(2-methylallyl)-3-(4-nitrophenyl)thiourea CAS Name: 1-ethyl-1-(2-methylprop-2-enyl)-3-(4-nitrophenyl)thiourea IUPAC Name: 1-ethyl-1-(2-methylprop-2-enyl)-3-(4-nitrophenyl)thiourea Traditional Name: 1-ethyl-1-(2-methylallyl)-3-(4-nitrophenyl)thiourea Formula: C13H17N3O2S MolecularWeight: 279.35798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O2S/c1-4-15(9-10(2)3)13(19)14-11-5-7-12(8-6-11)16(17)18/h5-8H,2,4,9H2,1,3H3,(H,14,19)