N-cycloheptyl-2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-cycloheptyl-2-[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-cycloheptyl-2-[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-cycloheptyl-2-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-cycloheptyl-2-[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-cycloheptyl-2-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]propionamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CCCOC

Isomeric SMILES

CC(C(=O)NC1CCCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CCCOC

InChI

InChI=1S/C22H31N3O3S/c1-16(20(26)23-17-10-5-3-4-6-11-17)29-22-24-19-13-8-7-12-18(19)21(27)25(22)14-9-15-28-2/h7-8,12-13,16-17H,3-6,9-11,14-15H2,1-2H3,(H,23,26)