N-(2-cyanoethyl)-2-[4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-phenyl-propanamide

Systemtic Name: N-(2-cyanoethyl)-2-[4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: N-(2-cyanoethyl)-2-[3-(3-isopropoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-phenyl-propanamide CAS Name: N-(2-cyanoethyl)-2-[[4-oxo-3-(3-propan-2-yloxypropyl)-2-quinazolinyl]thio]-N-phenylpropanamide IUPAC Name: N-(2-cyanoethyl)-2-[4-oxo-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-phenylpropanamide Traditional Name: N-(2-cyanoethyl)-2-[[3-(3-isopropoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-phenyl-propionamide Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)N(CCC#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)N(CCC#N)C3=CC=CC=C3

InChI

InChI=1S/C26H30N4O3S/c1-19(2)33-18-10-17-30-25(32)22-13-7-8-14-23(22)28-26(30)34-20(3)24(31)29(16-9-15-27)21-11-5-4-6-12-21/h4-8,11-14,19-20H,9-10,16-18H2,1-3H3