methyl N'-(oxolan-2-ylmethyl)-N,N-bis(phenylmethyl)carbamimidothioate

Systemtic Name: methyl N'-(oxolan-2-ylmethyl)-N,N-bis(phenylmethyl)carbamimidothioate Openeye Name: 1,1-dibenzyl-2-methyl-3-(tetrahydrofuran-2-ylmethyl)isothiourea CAS Name: N'-(2-oxolanylmethyl)-N,N-bis(phenylmethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N,N-dibenzyl-N'-(oxolan-2-ylmethyl)carbamimidothioate Traditional Name: 1,1-dibenzyl-2-methyl-3-(tetrahydrofurfuryl)isothiourea Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCC1CCCO1)N(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CSC(=NCC1CCCO1)N(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N2OS/c1-25-21(22-15-20-13-8-14-24-20)23(16-18-9-4-2-5-10-18)17-19-11-6-3-7-12-19/h2-7,9-12,20H,8,13-17H2,1H3