(4-phenylphenyl)methyl N'-[(2S)-butan-2-yl]carbamimidothioate

Systemtic Name: (4-phenylphenyl)methyl N'-[(2S)-butan-2-yl]carbamimidothioate Openeye Name: 3-[(1S)-1-methylpropyl]-2-[(4-phenylphenyl)methyl]isothiourea CAS Name: N'-[(2S)-butan-2-yl]carbamimidothioic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl N'-[(2S)-butan-2-yl]carbamimidothioate Traditional Name: 3-[(1S)-1-methylpropyl]-2-(4-phenylbenzyl)isothiourea Formula: C18H22N2S MolecularWeight: 298.44568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N=C(N)SCC1=CC=C(C=C1)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)N=C(N)SCC1=CC=C(C=C1)C2=CC=CC=C2

InChI

InChI=1S/C18H22N2S/c1-3-14(2)20-18(19)21-13-15-9-11-17(12-10-15)16-7-5-4-6-8-16/h4-12,14H,3,13H2,1-2H3,(H2,19,20)/t14-/m0/s1