1-(2-methoxyethyl)-3-[4-[6-(2-methoxyethylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea

Systemtic Name: 1-(2-methoxyethyl)-3-[4-[6-(2-methoxyethylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Openeye Name: 1-(2-methoxyethyl)-3-[4-[6-(2-methoxyethylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea CAS Name: 1-(2-methoxyethyl)-3-[4-[6-[[(2-methoxyethylamino)-sulfanylidenemethyl]amino]-1H-benzimidazol-2-yl]phenyl]thiourea IUPAC Name: 1-(2-methoxyethyl)-3-[4-[6-(2-methoxyethylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Traditional Name: 1-(2-methoxyethyl)-3-[4-[6-(2-methoxyethylthiocarbamoylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Formula: C21H26N6O2S2 MolecularWeight: 458.60014

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)NC(=S)NCCOC

Isomeric SMILES

COCCNC(=S)NC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)NC(=S)NCCOC

InChI

InChI=1S/C21H26N6O2S2/c1-28-11-9-22-20(30)24-15-5-3-14(4-6-15)19-26-17-8-7-16(13-18(17)27-19)25-21(31)23-10-12-29-2/h3-8,13H,9-12H2,1-2H3,(H,26,27)(H2,22,24,30)(H2,23,25,31)