8-propan-2-yl-2-pyridin-4-yl-4-thiophen-2-yl-1H-1,3,5-benzotriazepine

Systemtic Name: 8-propan-2-yl-2-pyridin-4-yl-4-thiophen-2-yl-1H-1,3,5-benzotriazepine Openeye Name: 8-isopropyl-2-(4-pyridyl)-4-(2-thienyl)-1H-1,3,5-benzotriazepine CAS Name: 8-propan-2-yl-2-pyridin-4-yl-4-thiophen-2-yl-1H-1,3,5-benzotriazepine IUPAC Name: 8-propan-2-yl-2-pyridin-4-yl-4-thiophen-2-yl-1H-1,3,5-benzotriazepine Traditional Name: 8-isopropyl-2-(4-pyridyl)-4-(2-thienyl)-1H-1,3,5-benzotriazepine Formula: C20H18N4S MolecularWeight: 346.44872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4S/c1-13(2)15-5-6-16-17(12-15)23-19(14-7-9-21-10-8-14)24-20(22-16)18-4-3-11-25-18/h3-13H,1-2H3,(H,22,23,24)