2-(1,3-benzothiazol-6-ylamino)-6-[(2-fluorophenyl)methylamino]-1H-1,3,5-triazin-4-one

Systemtic Name: 2-(1,3-benzothiazol-6-ylamino)-6-[(2-fluorophenyl)methylamino]-1H-1,3,5-triazin-4-one Openeye Name: 2-(1,3-benzothiazol-6-ylamino)-6-[(2-fluorophenyl)methylamino]-1H-1,3,5-triazin-4-one CAS Name: 2-(1,3-benzothiazol-6-ylamino)-6-[(2-fluorophenyl)methylamino]-1H-1,3,5-triazin-4-one IUPAC Name: 2-(1,3-benzothiazol-6-ylamino)-6-[(2-fluorophenyl)methylamino]-1H-1,3,5-triazin-4-one Traditional Name: 2-(1,3-benzothiazol-6-ylamino)-6-[(2-fluorobenzyl)amino]-1H-s-triazin-4-one Formula: C17H13FN6OS MolecularWeight: 368.388123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=NC(=O)N=C(N2)NC3=CC4=C(C=C3)N=CS4)F

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=NC(=O)N=C(N2)NC3=CC4=C(C=C3)N=CS4)F

InChI

InChI=1S/C17H13FN6OS/c18-12-4-2-1-3-10(12)8-19-15-22-16(24-17(25)23-15)21-11-5-6-13-14(7-11)26-9-20-13/h1-7,9H,8H2,(H3,19,21,22,23,24,25)