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

Systemtic Name: 7-ethyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Openeye Name: 7-ethyl-2-(p-tolyl)-5-(2-thienyl)-4H-1,3,4-benzotriazepine CAS Name: 7-ethyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine IUPAC Name: 7-ethyl-2-(4-methylphenyl)-5-thiophen-2-yl-4H-1,3,4-benzotriazepine Traditional Name: 7-ethyl-2-(p-tolyl)-5-(2-thienyl)-4H-1,3,4-benzotriazepine Formula: C21H19N3S MolecularWeight: 345.46066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)C)C4=CC=CS4

Isomeric SMILES

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)C)C4=CC=CS4

InChI

InChI=1S/C21H19N3S/c1-3-15-8-11-18-17(13-15)20(19-5-4-12-25-19)23-24-21(22-18)16-9-6-14(2)7-10-16/h4-13,23H,3H2,1-2H3