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

Systemtic Name: 2-[3-[(2S)-2-methylpyrrolidin-1-yl]cyclobutyl]-6-pyrimidin-5-yl-1,3-benzothiazole Openeye Name: 2-[3-[(2S)-2-methylpyrrolidin-1-yl]cyclobutyl]-6-pyrimidin-5-yl-1,3-benzothiazole CAS Name: 2-[3-[(2S)-2-methyl-1-pyrrolidinyl]cyclobutyl]-6-(5-pyrimidinyl)-1,3-benzothiazole IUPAC Name: 2-[3-[(2S)-2-methylpyrrolidin-1-yl]cyclobutyl]-6-pyrimidin-5-yl-1,3-benzothiazole Traditional Name: 2-[3-[(2S)-2-methylpyrrolidino]cyclobutyl]-6-(5-pyrimidyl)-1,3-benzothiazole Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1C2CC(C2)C3=NC4=C(S3)C=C(C=C4)C5=CN=CN=C5

Isomeric SMILES

C[C@H]1CCCN1C2CC(C2)C3=NC4=C(S3)C=C(C=C4)C5=CN=CN=C5

InChI

InChI=1S/C20H22N4S/c1-13-3-2-6-24(13)17-7-15(8-17)20-23-18-5-4-14(9-19(18)25-20)16-10-21-12-22-11-16/h4-5,9-13,15,17H,2-3,6-8H2,1H3/t13-,15?,17?/m0/s1