8-ethoxy-2-(5-methylfuran-2-yl)-4-thiophen-2-yl-1H-1,3,5-benzotriazepine

Systemtic Name: 8-ethoxy-2-(5-methylfuran-2-yl)-4-thiophen-2-yl-1H-1,3,5-benzotriazepine Openeye Name: 8-ethoxy-2-(5-methyl-2-furyl)-4-(2-thienyl)-1H-1,3,5-benzotriazepine CAS Name: 8-ethoxy-2-(5-methyl-2-furanyl)-4-thiophen-2-yl-1H-1,3,5-benzotriazepine IUPAC Name: 8-ethoxy-2-(5-methylfuran-2-yl)-4-thiophen-2-yl-1H-1,3,5-benzotriazepine Traditional Name: 8-ethoxy-2-(5-methyl-2-furyl)-4-(2-thienyl)-1H-1,3,5-benzotriazepine Formula: C19H17N3O2S MolecularWeight: 351.42218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C(N2)C3=CC=C(O3)C)C4=CC=CS4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C(N2)C3=CC=C(O3)C)C4=CC=CS4

InChI

InChI=1S/C19H17N3O2S/c1-3-23-13-7-8-14-15(11-13)21-18(16-9-6-12(2)24-16)22-19(20-14)17-5-4-10-25-17/h4-11H,3H2,1-2H3,(H,20,21,22)