2-phenyl-5-thiophen-2-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 2-phenyl-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 2-phenyl-5-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 2-phenyl-5-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 2-phenyl-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 2-phenyl-5-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C18H13N3S MolecularWeight: 303.38092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=C3C=CC=CC3=N2)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=C3C=CC=CC3=N2)C4=CC=CS4

InChI

InChI=1S/C18H13N3S/c1-2-7-13(8-3-1)18-19-15-10-5-4-9-14(15)17(20-21-18)16-11-6-12-22-16/h1-12,20H