6-chloranyl-3-[1-[2-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methylamino]quinazolin-4-yl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 6-chloranyl-3-[1-[2-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methylamino]quinazolin-4-yl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 6-chloro-3-[1-[2-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methylamino]quinazolin-4-yl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 6-chloro-3-[1-[2-[[2-[[2-(hydroxymethyl)phenyl]thio]phenyl]methylamino]-4-quinazolinyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 6-chloro-3-[1-[2-[[2-[2-(hydroxymethyl)phenyl]sulfanylphenyl]methylamino]quinazolin-4-yl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 6-chloro-3-[1-[2-[[2-[(2-methylolphenyl)thio]benzyl]amino]quinazolin-4-yl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C34H31ClN6O2S MolecularWeight: 623.16694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)C4=NC(=NC5=CC=CC=C54)NCC6=CC=CC=C6SC7=CC=CC=C7CO

Isomeric SMILES

C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)C4=NC(=NC5=CC=CC=C54)NCC6=CC=CC=C6SC7=CC=CC=C7CO

InChI

InChI=1S/C34H31ClN6O2S/c35-24-13-14-29-28(19-24)38-34(43)41(29)25-15-17-40(18-16-25)32-26-9-3-4-10-27(26)37-33(39-32)36-20-22-7-1-5-11-30(22)44-31-12-6-2-8-23(31)21-42/h1-14,19,25,42H,15-18,20-21H2,(H,38,43)(H,36,37,39)