N-(3-propan-2-yloxypropyl)-2-[4-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]phenyl]ethanamide

Systemtic Name: N-(3-propan-2-yloxypropyl)-2-[4-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]phenyl]ethanamide Openeye Name: N-(3-isopropoxypropyl)-2-[4-[(2-thioxo-1H-quinazolin-4-yl)amino]phenyl]acetamide CAS Name: N-(3-propan-2-yloxypropyl)-2-[4-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]phenyl]acetamide IUPAC Name: N-(3-propan-2-yloxypropyl)-2-[4-[(2-sulfanylidene-1H-quinazolin-4-yl)amino]phenyl]acetamide Traditional Name: N-(3-isopropoxypropyl)-2-[4-[(2-thioxo-1H-quinazolin-4-yl)amino]phenyl]acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CC1=CC=C(C=C1)NC2=NC(=S)NC3=CC=CC=C32

Isomeric SMILES

CC(C)OCCCNC(=O)CC1=CC=C(C=C1)NC2=NC(=S)NC3=CC=CC=C32

InChI

InChI=1S/C22H26N4O2S/c1-15(2)28-13-5-12-23-20(27)14-16-8-10-17(11-9-16)24-21-18-6-3-4-7-19(18)25-22(29)26-21/h3-4,6-11,15H,5,12-14H2,1-2H3,(H,23,27)(H2,24,25,26,29)