[2-(4-methylphenyl)-1H-indol-3-yl] carbamimidothioate

Systemtic Name: [2-(4-methylphenyl)-1H-indol-3-yl] carbamimidothioate Openeye Name: 2-[2-(p-tolyl)-1H-indol-3-yl]isothiourea CAS Name: carbamimidothioic acid [2-(4-methylphenyl)-1H-indol-3-yl] ester IUPAC Name: [2-(4-methylphenyl)-1H-indol-3-yl] carbamimidothioate Traditional Name: 2-[2-(p-tolyl)-1H-indol-3-yl]isothiourea Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)SC(=N)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)SC(=N)N

InChI

InChI=1S/C16H15N3S/c1-10-6-8-11(9-7-10)14-15(20-16(17)18)12-4-2-3-5-13(12)19-14/h2-9,19H,1H3,(H3,17,18)