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

Systemtic Name: 7-ethyl-5-(5-methylfuran-2-yl)-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine Openeye Name: 7-ethyl-5-(5-methyl-2-furyl)-2-(p-tolyl)-4H-1,3,4-benzotriazepine CAS Name: 7-ethyl-5-(5-methyl-2-furanyl)-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine IUPAC Name: 7-ethyl-5-(5-methylfuran-2-yl)-2-(4-methylphenyl)-4H-1,3,4-benzotriazepine Traditional Name: 7-ethyl-5-(5-methyl-2-furyl)-2-(p-tolyl)-4H-1,3,4-benzotriazepine Formula: C22H21N3O MolecularWeight: 343.42164

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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=C(O4)C

Isomeric SMILES

CCC1=CC2=C(NN=C(N=C2C=C1)C3=CC=C(C=C3)C)C4=CC=C(O4)C

InChI

InChI=1S/C22H21N3O/c1-4-16-8-11-19-18(13-16)21(20-12-7-15(3)26-20)24-25-22(23-19)17-9-5-14(2)6-10-17/h5-13,24H,4H2,1-3H3