(2S)-2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-propyl-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-propyl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-propyl-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxyphenyl]-3-propyl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]-3-propyl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxy-phenyl]-3-propyl-1,2-dihydroquinazolin-4-one Formula: C26H25N3O2S2 MolecularWeight: 475.6256

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)OC)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

CCCN1[C@H](NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)OC)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C26H25N3O2S2/c1-3-14-29-24(27-20-9-5-4-8-19(20)25(29)30)17-12-13-22(31-2)18(15-17)16-32-26-28-21-10-6-7-11-23(21)33-26/h4-13,15,24,27H,3,14,16H2,1-2H3/t24-/m0/s1