1-heptan-2-yl-3-[(4-methylphenyl)methyl]thiourea

Systemtic Name: 1-heptan-2-yl-3-[(4-methylphenyl)methyl]thiourea Openeye Name: 1-(1-methylhexyl)-3-(p-tolylmethyl)thiourea CAS Name: 1-heptan-2-yl-3-[(4-methylphenyl)methyl]thiourea IUPAC Name: 1-heptan-2-yl-3-[(4-methylphenyl)methyl]thiourea Traditional Name: 1-(4-methylbenzyl)-3-(1-methylhexyl)thiourea Formula: C16H26N2S MolecularWeight: 278.45604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=S)NCC1=CC=C(C=C1)C

Isomeric SMILES

CCCCCC(C)NC(=S)NCC1=CC=C(C=C1)C

InChI

InChI=1S/C16H26N2S/c1-4-5-6-7-14(3)18-16(19)17-12-15-10-8-13(2)9-11-15/h8-11,14H,4-7,12H2,1-3H3,(H2,17,18,19)