naphthalen-1-ylmethyl N'-(3,5-dimethylphenyl)carbamimidothioate

Systemtic Name: naphthalen-1-ylmethyl N'-(3,5-dimethylphenyl)carbamimidothioate Openeye Name: 3-(3,5-dimethylphenyl)-2-(1-naphthylmethyl)isothiourea CAS Name: N'-(3,5-dimethylphenyl)carbamimidothioic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl N'-(3,5-dimethylphenyl)carbamimidothioate Traditional Name: 3-(3,5-dimethylphenyl)-2-(1-naphthylmethyl)isothiourea Formula: C20H20N2S MolecularWeight: 320.4512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N=C(N)SCC2=CC=CC3=CC=CC=C32)C

Isomeric SMILES

CC1=CC(=CC(=C1)N=C(N)SCC2=CC=CC3=CC=CC=C32)C

InChI

InChI=1S/C20H20N2S/c1-14-10-15(2)12-18(11-14)22-20(21)23-13-17-8-5-7-16-6-3-4-9-19(16)17/h3-12H,13H2,1-2H3,(H2,21,22)