(2R)-2-azanyl-3-sulfanyl-N-[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl]propanamide

Systemtic Name: (2R)-2-azanyl-3-sulfanyl-N-[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl]propanamide Openeye Name: (2R)-2-amino-3-sulfanyl-N-[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl]propanamide CAS Name: (2R)-2-amino-3-mercapto-N-[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl]propanamide IUPAC Name: (2R)-2-amino-3-sulfanyl-N-[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl]propanamide Traditional Name: (2R)-2-amino-3-mercapto-N-[8-(1,2,3,4-tetrahydroacridin-9-ylamino)octyl]propionamide Formula: C24H36N4OS MolecularWeight: 428.63384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=CC=CC=C3C(=C2C1)NCCCCCCCCNC(=O)C(CS)N

Isomeric SMILES

C1CCC2=NC3=CC=CC=C3C(=C2C1)NCCCCCCCCNC(=O)[C@H](CS)N

InChI

InChI=1S/C24H36N4OS/c25-20(17-30)24(29)27-16-10-4-2-1-3-9-15-26-23-18-11-5-7-13-21(18)28-22-14-8-6-12-19(22)23/h5,7,11,13,20,30H,1-4,6,8-10,12,14-17,25H2,(H,26,28)(H,27,29)/t20-/m0/s1