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

Systemtic Name: 7-methoxy-5-phenyl-2-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-methoxy-5-phenyl-2-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 7-methoxy-5-phenyl-2-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-methoxy-5-phenyl-2-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-methoxy-5-phenyl-2-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C19H15N3OS MolecularWeight: 333.4069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(NN=C(N=C2C=C1)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(NN=C(N=C2C=C1)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C19H15N3OS/c1-23-14-9-10-16-15(12-14)18(13-6-3-2-4-7-13)21-22-19(20-16)17-8-5-11-24-17/h2-12,21H,1H3