2-[3-[(2S)-2-methylpiperidin-1-yl]cyclobutyl]-4-pyrrolidin-1-yl-1,3-benzothiazole-6-carbaldehyde

Systemtic Name: 2-[3-[(2S)-2-methylpiperidin-1-yl]cyclobutyl]-4-pyrrolidin-1-yl-1,3-benzothiazole-6-carbaldehyde Openeye Name: 2-[3-[(2S)-2-methyl-1-piperidyl]cyclobutyl]-4-pyrrolidin-1-yl-1,3-benzothiazole-6-carbaldehyde CAS Name: 2-[3-[(2S)-2-methyl-1-piperidinyl]cyclobutyl]-4-(1-pyrrolidinyl)-1,3-benzothiazole-6-carboxaldehyde IUPAC Name: 2-[3-[(2S)-2-methylpiperidin-1-yl]cyclobutyl]-4-pyrrolidin-1-yl-1,3-benzothiazole-6-carbaldehyde Traditional Name: 2-[3-[(2S)-2-methylpiperidino]cyclobutyl]-4-pyrrolidino-1,3-benzothiazole-6-carbaldehyde Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2CC(C2)C3=NC4=C(C=C(C=C4S3)C=O)N5CCCC5

Isomeric SMILES

C[C@H]1CCCCN1C2CC(C2)C3=NC4=C(C=C(C=C4S3)C=O)N5CCCC5

InChI

InChI=1S/C22H29N3OS/c1-15-6-2-3-9-25(15)18-12-17(13-18)22-23-21-19(24-7-4-5-8-24)10-16(14-26)11-20(21)27-22/h10-11,14-15,17-18H,2-9,12-13H2,1H3/t15-,17?,18?/m0/s1