ethyl 1-[2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)ethanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)ethanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)acetyl]piperidine-3-carboxylate CAS Name: 1-[2-(6-benzimidazolo[1,2-c]quinazolinylthio)-1-oxoethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(benzimidazolo[1,2-c]quinazolin-6-ylsulfanyl)acetyl]piperidine-3-carboxylate Traditional Name: 1-[2-(benzimidazolo[1,2-c]quinazolin-6-ylthio)acetyl]nipecotic acid ethyl ester Formula: C24H24N4O3S MolecularWeight: 448.53736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CSC2=NC3=CC=CC=C3C4=NC5=CC=CC=C5N42

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CSC2=NC3=CC=CC=C3C4=NC5=CC=CC=C5N42

InChI

InChI=1S/C24H24N4O3S/c1-2-31-23(30)16-8-7-13-27(14-16)21(29)15-32-24-26-18-10-4-3-9-17(18)22-25-19-11-5-6-12-20(19)28(22)24/h3-6,9-12,16H,2,7-8,13-15H2,1H3