1-heptan-2-yl-3-(2-methoxy-5-methyl-phenyl)thiourea

Systemtic Name: 1-heptan-2-yl-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-(2-methoxy-5-methyl-phenyl)-3-(1-methylhexyl)thiourea CAS Name: 1-heptan-2-yl-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-heptan-2-yl-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-(2-methoxy-5-methyl-phenyl)-3-(1-methylhexyl)thiourea Formula: C16H26N2OS MolecularWeight: 294.45544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=S)NC1=C(C=CC(=C1)C)OC

Isomeric SMILES

CCCCCC(C)NC(=S)NC1=C(C=CC(=C1)C)OC

InChI

InChI=1S/C16H26N2OS/c1-5-6-7-8-13(3)17-16(20)18-14-11-12(2)9-10-15(14)19-4/h9-11,13H,5-8H2,1-4H3,(H2,17,18,20)