2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)-N-(2-methylpropylcarbamoyl)propanamide

Systemtic Name: 2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)-N-(2-methylpropylcarbamoyl)propanamide Openeye Name: 2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)-N-(isobutylcarbamoyl)propanamide CAS Name: 2-(6-benzimidazolo[1,2-c]quinazolinylthio)-N-[(2-methylpropylamino)-oxomethyl]propanamide IUPAC Name: 2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)-N-(2-methylpropylcarbamoyl)propanamide Traditional Name: 2-(benzimidazolo[1,2-c]quinazolin-6-ylthio)-N-(isobutylcarbamoyl)propionamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)C(C)SC1=NC2=CC=CC=C2C3=NC4=CC=CC=C4N31

Isomeric SMILES

CC(C)CNC(=O)NC(=O)C(C)SC1=NC2=CC=CC=C2C3=NC4=CC=CC=C4N31

InChI

InChI=1S/C22H23N5O2S/c1-13(2)12-23-21(29)26-20(28)14(3)30-22-25-16-9-5-4-8-15(16)19-24-17-10-6-7-11-18(17)27(19)22/h4-11,13-14H,12H2,1-3H3,(H2,23,26,28,29)