1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethylpyrrolidin-2-yl)methylcarbamothioylamino]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethylpyrrolidin-2-yl)methylcarbamothioylamino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethylpyrrolidin-2-yl)methylcarbamothioylamino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[[(1-ethyl-2-pyrrolidinyl)methylamino]-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(1-ethylpyrrolidin-2-yl)methylcarbamothioylamino]thiourea Traditional Name: 1-[(1-ethylpyrrolidin-2-yl)methyl]-3-(homoveratrylthiocarbamoylamino)thiourea Formula: C19H31N5O2S2 MolecularWeight: 425.61174

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=S)NNC(=S)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCN1CCCC1CNC(=S)NNC(=S)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C19H31N5O2S2/c1-4-24-11-5-6-15(24)13-21-19(28)23-22-18(27)20-10-9-14-7-8-16(25-2)17(12-14)26-3/h7-8,12,15H,4-6,9-11,13H2,1-3H3,(H2,20,22,27)(H2,21,23,28)