1-(3-methoxypropyl)-3-[4-[6-(3-methoxypropylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea

Systemtic Name: 1-(3-methoxypropyl)-3-[4-[6-(3-methoxypropylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Openeye Name: 1-(3-methoxypropyl)-3-[4-[6-(3-methoxypropylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea CAS Name: 1-(3-methoxypropyl)-3-[4-[6-[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]-1H-benzimidazol-2-yl]phenyl]thiourea IUPAC Name: 1-(3-methoxypropyl)-3-[4-[6-(3-methoxypropylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Traditional Name: 1-(3-methoxypropyl)-3-[4-[6-(3-methoxypropylthiocarbamoylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Formula: C23H30N6O2S2 MolecularWeight: 486.6533

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)NC(=S)NCCCOC

Isomeric SMILES

COCCCNC(=S)NC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)NC(=S)NCCCOC

InChI

InChI=1S/C23H30N6O2S2/c1-30-13-3-11-24-22(32)26-17-7-5-16(6-8-17)21-28-19-10-9-18(15-20(19)29-21)27-23(33)25-12-4-14-31-2/h5-10,15H,3-4,11-14H2,1-2H3,(H,28,29)(H2,24,26,32)(H2,25,27,33)