(4R,4aS)-2-(1,3-benzothiazol-2-ylamino)-4-phenyl-4a,6,7,8-tetrahydro-4H-quinazolin-5-one

Systemtic Name: (4R,4aS)-2-(1,3-benzothiazol-2-ylamino)-4-phenyl-4a,6,7,8-tetrahydro-4H-quinazolin-5-one Openeye Name: (4R,4aS)-2-(1,3-benzothiazol-2-ylamino)-4-phenyl-4a,6,7,8-tetrahydro-4H-quinazolin-5-one CAS Name: (4R,4aS)-2-(1,3-benzothiazol-2-ylamino)-4-phenyl-4a,6,7,8-tetrahydro-4H-quinazolin-5-one IUPAC Name: (4R,4aS)-2-(1,3-benzothiazol-2-ylamino)-4-phenyl-4a,6,7,8-tetrahydro-4H-quinazolin-5-one Traditional Name: (4R,4aS)-2-(1,3-benzothiazol-2-ylamino)-4-phenyl-4a,6,7,8-tetrahydro-4H-quinazolin-5-one Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC(=NC(C2C(=O)C1)C3=CC=CC=C3)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC2=NC(=N[C@H]([C@@H]2C(=O)C1)C3=CC=CC=C3)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H18N4OS/c26-16-11-6-10-15-18(16)19(13-7-2-1-3-8-13)24-20(22-15)25-21-23-14-9-4-5-12-17(14)27-21/h1-5,7-9,12,18-19H,6,10-11H2,(H,23,24,25)/t18-,19-/m0/s1