methyl N-(4-cyanophenyl)-N'-(2,3-dihydro-1H-inden-2-yl)carbamimidothioate

Systemtic Name: methyl N-(4-cyanophenyl)-N'-(2,3-dihydro-1H-inden-2-yl)carbamimidothioate Openeye Name: 1-(4-cyanophenyl)-3-indan-2-yl-2-methyl-isothiourea CAS Name: N-(4-cyanophenyl)-N'-(2,3-dihydro-1H-inden-2-yl)carbamimidothioic acid methyl ester IUPAC Name: methyl N-(4-cyanophenyl)-N'-(2,3-dihydro-1H-inden-2-yl)carbamimidothioate Traditional Name: 1-(4-cyanophenyl)-3-indan-2-yl-2-methyl-isothiourea Formula: C18H17N3S MolecularWeight: 307.41268

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1CC2=CC=CC=C2C1)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CSC(=NC1CC2=CC=CC=C2C1)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H17N3S/c1-22-18(20-16-8-6-13(12-19)7-9-16)21-17-10-14-4-2-3-5-15(14)11-17/h2-9,17H,10-11H2,1H3,(H,20,21)