1-(azepan-1-yl)-4-thiophen-2-yl-phthalazine

Systemtic Name: 1-(azepan-1-yl)-4-thiophen-2-yl-phthalazine Openeye Name: 1-(azepan-1-yl)-4-(2-thienyl)phthalazine CAS Name: 1-(1-azepanyl)-4-thiophen-2-ylphthalazine IUPAC Name: 1-(azepan-1-yl)-4-thiophen-2-ylphthalazine Traditional Name: 1-(azepan-1-yl)-4-(2-thienyl)phthalazine Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C18H19N3S/c1-2-6-12-21(11-5-1)18-15-9-4-3-8-14(15)17(19-20-18)16-10-7-13-22-16/h3-4,7-10,13H,1-2,5-6,11-12H2