2-[3-(azepan-1-yl)cyclobutyl]-6-pyrimidin-5-yl-1,3-benzothiazole

Systemtic Name: 2-[3-(azepan-1-yl)cyclobutyl]-6-pyrimidin-5-yl-1,3-benzothiazole Openeye Name: 2-[3-(azepan-1-yl)cyclobutyl]-6-pyrimidin-5-yl-1,3-benzothiazole CAS Name: 2-[3-(1-azepanyl)cyclobutyl]-6-(5-pyrimidinyl)-1,3-benzothiazole IUPAC Name: 2-[3-(azepan-1-yl)cyclobutyl]-6-pyrimidin-5-yl-1,3-benzothiazole Traditional Name: 2-[3-(azepan-1-yl)cyclobutyl]-6-(5-pyrimidyl)-1,3-benzothiazole Formula: C21H24N4S MolecularWeight: 364.50706

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2CC(C2)C3=NC4=C(S3)C=C(C=C4)C5=CN=CN=C5

Isomeric SMILES

C1CCCN(CC1)C2CC(C2)C3=NC4=C(S3)C=C(C=C4)C5=CN=CN=C5

InChI

InChI=1S/C21H24N4S/c1-2-4-8-25(7-3-1)18-9-16(10-18)21-24-19-6-5-15(11-20(19)26-21)17-12-22-14-23-13-17/h5-6,11-14,16,18H,1-4,7-10H2