N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H23N5O2S/c1-30-13-12-18(21-25-16-8-4-5-9-17(16)26-21)24-20(28)11-10-19-23-15-7-3-2-6-14(15)22(29)27-19/h2-9,18H,10-13H2,1H3,(H,24,28)(H,25,26)(H,23,27,29)