N-(4-methoxyphenyl)-4-[2-[(4-methoxyphenyl)carbamothioylamino]ethyl]piperazine-1-carbothioamide hydrochloride

Systemtic Name: N-(4-methoxyphenyl)-4-[2-[(4-methoxyphenyl)carbamothioylamino]ethyl]piperazine-1-carbothioamide hydrochloride Openeye Name: N-(4-methoxyphenyl)-4-[2-[(4-methoxyphenyl)carbamothioylamino]ethyl]piperazine-1-carbothioamide hydrochloride CAS Name: 4-[2-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]ethyl]-N-(4-methoxyphenyl)-1-piperazinecarbothioamide hydrochloride IUPAC Name: N-(4-methoxyphenyl)-4-[2-[(4-methoxyphenyl)carbamothioylamino]ethyl]piperazine-1-carbothioamide hydrochloride Traditional Name: N-(4-methoxyphenyl)-4-[2-[(4-methoxyphenyl)thiocarbamoylamino]ethyl]piperazine-1-carbothioamide hydrochloride Formula: C22H30ClN5O2S2 MolecularWeight: 496.0889

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NCCN2CCN(CC2)C(=S)NC3=CC=C(C=C3)OC.Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NCCN2CCN(CC2)C(=S)NC3=CC=C(C=C3)OC.Cl

InChI

InChI=1S/C22H29N5O2S2.ClH/c1-28-19-7-3-17(4-8-19)24-21(30)23-11-12-26-13-15-27(16-14-26)22(31)25-18-5-9-20(29-2)10-6-18;/h3-10H,11-16H2,1-2H3,(H,25,31)(H2,23,24,30);1H