3-[2-(azocan-1-ylsulfonyl)ethyl]quinazolin-4-one

Systemtic Name: 3-[2-(azocan-1-ylsulfonyl)ethyl]quinazolin-4-one Openeye Name: 3-[2-(azocan-1-ylsulfonyl)ethyl]quinazolin-4-one CAS Name: 3-[2-(1-azocanylsulfonyl)ethyl]-4-quinazolinone IUPAC Name: 3-[2-(azocan-1-ylsulfonyl)ethyl]quinazolin-4-one Traditional Name: 3-[2-(azocan-1-ylsulfonyl)ethyl]quinazolin-4-one Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)S(=O)(=O)CCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C1CCCN(CCC1)S(=O)(=O)CCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H23N3O3S/c21-17-15-8-4-5-9-16(15)18-14-19(17)12-13-24(22,23)20-10-6-2-1-3-7-11-20/h4-5,8-9,14H,1-3,6-7,10-13H2