2-(4-chlorophenyl)-8-fluoranyl-4-thiophen-2-yl-1H-1,3,5-benzotriazepine

Systemtic Name: 2-(4-chlorophenyl)-8-fluoranyl-4-thiophen-2-yl-1H-1,3,5-benzotriazepine Openeye Name: 2-(4-chlorophenyl)-8-fluoro-4-(2-thienyl)-1H-1,3,5-benzotriazepine CAS Name: 2-(4-chlorophenyl)-8-fluoro-4-thiophen-2-yl-1H-1,3,5-benzotriazepine IUPAC Name: 2-(4-chlorophenyl)-8-fluoro-4-thiophen-2-yl-1H-1,3,5-benzotriazepine Traditional Name: 2-(4-chlorophenyl)-8-fluoro-4-(2-thienyl)-1H-1,3,5-benzotriazepine Formula: C18H11ClFN3S MolecularWeight: 355.816443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC3=C(C=C(C=C3)F)NC(=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CSC(=C1)C2=NC3=C(C=C(C=C3)F)NC(=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H11ClFN3S/c19-12-5-3-11(4-6-12)17-22-15-10-13(20)7-8-14(15)21-18(23-17)16-2-1-9-24-16/h1-10H,(H,21,22,23)