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

Systemtic Name: 1-phenyl-3-[4-[6-(phenylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Openeye Name: 1-phenyl-3-[4-[6-(phenylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea CAS Name: 1-[4-[6-[[anilino(sulfanylidene)methyl]amino]-1H-benzimidazol-2-yl]phenyl]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[4-[6-(phenylcarbamothioylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Traditional Name: 1-phenyl-3-[4-[6-(phenylthiocarbamoylamino)-1H-benzimidazol-2-yl]phenyl]thiourea Formula: C27H22N6S2 MolecularWeight: 494.63378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC(=S)NC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)C3=NC4=C(N3)C=C(C=C4)NC(=S)NC5=CC=CC=C5

InChI

InChI=1S/C27H22N6S2/c34-26(28-19-7-3-1-4-8-19)30-21-13-11-18(12-14-21)25-32-23-16-15-22(17-24(23)33-25)31-27(35)29-20-9-5-2-6-10-20/h1-17H,(H,32,33)(H2,28,30,34)(H2,29,31,35)