6-[3-(4-phenylbutan-2-yl)-2-phenylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(4-phenylbutan-2-yl)-2-phenylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(1-methyl-3-phenyl-propyl)-2-phenylimino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(4-phenylbutan-2-yl)-2-phenylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(4-phenylbutan-2-yl)-2-phenylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(1-methyl-3-phenyl-propyl)-2-phenylimino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N2C(=CSC2=NC3=CC=CC=C3)C4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

CC(CCC1=CC=CC=C1)N2C(=CSC2=NC3=CC=CC=C3)C4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C27H25N3O2S/c1-19(12-13-20-8-4-2-5-9-20)30-24(18-33-27(30)28-22-10-6-3-7-11-22)21-14-15-25-23(16-21)29-26(31)17-32-25/h2-11,14-16,18-19H,12-13,17H2,1H3,(H,29,31)