(3S)-1-(1,3-benzothiazol-2-yl)-N-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-3-amine

Systemtic Name: (3S)-1-(1,3-benzothiazol-2-yl)-N-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-3-amine Openeye Name: (3S)-1-(1,3-benzothiazol-2-yl)-N-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-3-amine CAS Name: (3S)-1-(1,3-benzothiazol-2-yl)-N-[(2-butyl-1H-imidazol-5-yl)methyl]-3-piperidinamine IUPAC Name: (3S)-1-(1,3-benzothiazol-2-yl)-N-[(2-butyl-1H-imidazol-5-yl)methyl]piperidin-3-amine Traditional Name: [(3S)-1-(1,3-benzothiazol-2-yl)-3-piperidyl]-[(2-butyl-1H-imidazol-5-yl)methyl]amine Formula: C20H27N5S MolecularWeight: 369.52688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1)CNC2CCCN(C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCC1=NC=C(N1)CN[C@H]2CCCN(C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H27N5S/c1-2-3-10-19-22-13-16(23-19)12-21-15-7-6-11-25(14-15)20-24-17-8-4-5-9-18(17)26-20/h4-5,8-9,13,15,21H,2-3,6-7,10-12,14H2,1H3,(H,22,23)/t15-/m0/s1