N-[(1-cyclopentylpiperidin-4-yl)methyl]-N-(pyridin-3-ylmethyl)thian-4-amine

Systemtic Name: N-[(1-cyclopentylpiperidin-4-yl)methyl]-N-(pyridin-3-ylmethyl)thian-4-amine Openeye Name: N-[(1-cyclopentyl-4-piperidyl)methyl]-N-(3-pyridylmethyl)tetrahydrothiopyran-4-amine CAS Name: N-[(1-cyclopentyl-4-piperidinyl)methyl]-N-(3-pyridinylmethyl)-4-thianamine IUPAC Name: N-[(1-cyclopentylpiperidin-4-yl)methyl]-N-(pyridin-3-ylmethyl)thian-4-amine Traditional Name: (1-cyclopentyl-4-piperidyl)methyl-(3-pyridylmethyl)-tetrahydrothiopyran-4-yl-amine Formula: C22H35N3S MolecularWeight: 373.5984

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCC(CC2)CN(CC3=CN=CC=C3)C4CCSCC4

Isomeric SMILES

C1CCC(C1)N2CCC(CC2)CN(CC3=CN=CC=C3)C4CCSCC4

InChI

InChI=1S/C22H35N3S/c1-2-6-21(5-1)24-12-7-19(8-13-24)17-25(22-9-14-26-15-10-22)18-20-4-3-11-23-16-20/h3-4,11,16,19,21-22H,1-2,5-10,12-15,17-18H2