1-heptyl-3-(2-methoxy-5-methyl-phenyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC1=C(C=CC(=C1)C)OC

Isomeric SMILES

CCCCCCCNC(=S)NC1=C(C=CC(=C1)C)OC

InChI

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