7-bromanyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine

Systemtic Name: 7-bromanyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-bromo-2-(p-tolyl)-5-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 7-bromo-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-bromo-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-bromo-2-(p-tolyl)-5-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C19H14BrN3S MolecularWeight: 396.30356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)Br)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C3C=C(C=CC3=N2)Br)C4=CC=CS4

InChI

InChI=1S/C19H14BrN3S/c1-12-4-6-13(7-5-12)19-21-16-9-8-14(20)11-15(16)18(22-23-19)17-3-2-10-24-17/h2-11,22H,1H3