N-[1-(2-morpholin-4-ylethylamino)-1-oxidanylidene-3-phenylsulfanyl-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[1-(2-morpholin-4-ylethylamino)-1-oxidanylidene-3-phenylsulfanyl-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-(2-morpholinoethylamino)-2-oxo-1-(phenylsulfanylmethyl)ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-[2-(4-morpholinyl)ethylamino]-1-oxo-3-(phenylthio)propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-[1-(2-morpholin-4-ylethylamino)-1-oxo-3-phenylsulfanylpropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-keto-2-(2-morpholinoethylamino)-1-[(phenylthio)methyl]ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C28H30N6O3S MolecularWeight: 530.6412

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)C(CSC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=NC=C5

Isomeric SMILES

C1COCCN1CCNC(=O)C(CSC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=NC=C5

InChI

InChI=1S/C28H30N6O3S/c35-27(21-6-7-23-24(18-21)32-26(31-23)20-8-10-29-11-9-20)33-25(19-38-22-4-2-1-3-5-22)28(36)30-12-13-34-14-16-37-17-15-34/h1-11,18,25H,12-17,19H2,(H,30,36)(H,31,32)(H,33,35)