3-(6-methylheptyl)-2-[(2-phenyl-1,3-thiazol-5-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(6-methylheptyl)-2-[(2-phenyl-1,3-thiazol-5-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(6-methylheptyl)-2-[(2-phenylthiazol-5-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(6-methylheptyl)-2-[(2-phenyl-5-thiazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-(6-methylheptyl)-2-[(2-phenyl-1,3-thiazol-5-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(6-methylheptyl)-2-[(2-phenylthiazol-5-yl)methylthio]quinazolin-4-one Formula: C26H29N3OS2 MolecularWeight: 463.65796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CN=C(S3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3OS2/c1-19(2)11-5-4-10-16-29-25(30)22-14-8-9-15-23(22)28-26(29)31-18-21-17-27-24(32-21)20-12-6-3-7-13-20/h3,6-9,12-15,17,19H,4-5,10-11,16,18H2,1-2H3