methyl N'-[(S)-(4-bromophenyl)-phenyl-methyl]carbamimidothioate

Systemtic Name: methyl N'-[(S)-(4-bromophenyl)-phenyl-methyl]carbamimidothioate Openeye Name: 3-[(S)-(4-bromophenyl)-phenyl-methyl]-2-methyl-isothiourea CAS Name: N'-[(S)-(4-bromophenyl)-phenylmethyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[(S)-(4-bromophenyl)-phenylmethyl]carbamimidothioate Traditional Name: 3-[(S)-(4-bromophenyl)-phenyl-methyl]-2-methyl-isothiourea Formula: C15H15BrN2S MolecularWeight: 335.262

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC(C1=CC=CC=C1)C2=CC=C(C=C2)Br)N

Isomeric SMILES

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

InChI

InChI=1S/C15H15BrN2S/c1-19-15(17)18-14(11-5-3-2-4-6-11)12-7-9-13(16)10-8-12/h2-10,14H,1H3,(H2,17,18)/t14-/m0/s1