3-(3-propan-2-yloxypropyl)-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(3-propan-2-yloxypropyl)-2-[(4-pyrrolidin-1-ylcarbonylphenyl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-isopropoxypropyl)-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methylthio]-3-(3-propan-2-yloxypropyl)-4-quinazolinone IUPAC Name: 3-(3-propan-2-yloxypropyl)-2-[[4-(pyrrolidine-1-carbonyl)phenyl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-isopropoxypropyl)-2-[[4-(pyrrolidine-1-carbonyl)benzyl]thio]quinazolin-4-one Formula: C26H31N3O3S MolecularWeight: 465.60764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C26H31N3O3S/c1-19(2)32-17-7-16-29-25(31)22-8-3-4-9-23(22)27-26(29)33-18-20-10-12-21(13-11-20)24(30)28-14-5-6-15-28/h3-4,8-13,19H,5-7,14-18H2,1-2H3