methyl N'-[2-[bis(2-methoxyethyl)amino]phenyl]carbamimidothioate

Systemtic Name: methyl N'-[2-[bis(2-methoxyethyl)amino]phenyl]carbamimidothioate Openeye Name: 3-[2-[bis(2-methoxyethyl)amino]phenyl]-2-methyl-isothiourea CAS Name: N'-[2-[bis(2-methoxyethyl)amino]phenyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-[bis(2-methoxyethyl)amino]phenyl]carbamimidothioate Traditional Name: 3-[2-[bis(2-methoxyethyl)amino]phenyl]-2-methyl-isothiourea Formula: C14H23N3O2S MolecularWeight: 297.41632

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=CC=CC=C1N=C(N)SC

Isomeric SMILES

COCCN(CCOC)C1=CC=CC=C1N=C(N)SC

InChI

InChI=1S/C14H23N3O2S/c1-18-10-8-17(9-11-19-2)13-7-5-4-6-12(13)16-14(15)20-3/h4-7H,8-11H2,1-3H3,(H2,15,16)