1-methyl-3-[(2S)-6-methylheptan-2-yl]-1-phenyl-thiourea

Systemtic Name: 1-methyl-3-[(2S)-6-methylheptan-2-yl]-1-phenyl-thiourea Openeye Name: 3-[(1S)-1,5-dimethylhexyl]-1-methyl-1-phenyl-thiourea CAS Name: 1-methyl-3-[(2S)-6-methylheptan-2-yl]-1-phenylthiourea IUPAC Name: 1-methyl-3-[(2S)-6-methylheptan-2-yl]-1-phenylthiourea Traditional Name: 3-[(1S)-1,5-dimethylhexyl]-1-methyl-1-phenyl-thiourea Formula: C16H26N2S MolecularWeight: 278.45604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=S)N(C)C1=CC=CC=C1

Isomeric SMILES

C[C@@H](CCCC(C)C)NC(=S)N(C)C1=CC=CC=C1

InChI

InChI=1S/C16H26N2S/c1-13(2)9-8-10-14(3)17-16(19)18(4)15-11-6-5-7-12-15/h5-7,11-14H,8-10H2,1-4H3,(H,17,19)/t14-/m0/s1