1-butyl-1-methyl-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-butyl-1-methyl-3-(4-nitrophenyl)thiourea Openeye Name: 1-butyl-1-methyl-3-(4-nitrophenyl)thiourea CAS Name: 1-butyl-1-methyl-3-(4-nitrophenyl)thiourea IUPAC Name: 1-butyl-1-methyl-3-(4-nitrophenyl)thiourea Traditional Name: 1-butyl-1-methyl-3-(4-nitrophenyl)thiourea Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O2S/c1-3-4-9-14(2)12(18)13-10-5-7-11(8-6-10)15(16)17/h5-8H,3-4,9H2,1-2H3,(H,13,18)