(2S)-3-[4-(aminomethyl)phenyl]-N-cyclopentyl-N-methyl-2-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]propanamide

Systemtic Name: (2S)-3-[4-(aminomethyl)phenyl]-N-cyclopentyl-N-methyl-2-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]propanamide Openeye Name: (2S)-3-[4-(aminomethyl)phenyl]-N-cyclopentyl-N-methyl-2-[[5-(2-pyridyl)-2-thienyl]sulfonylamino]propanamide CAS Name: (2S)-3-[4-(aminomethyl)phenyl]-N-cyclopentyl-N-methyl-2-[[5-(2-pyridinyl)-2-thiophenyl]sulfonylamino]propanamide IUPAC Name: (2S)-3-[4-(aminomethyl)phenyl]-N-cyclopentyl-N-methyl-2-[(5-pyridin-2-ylthiophen-2-yl)sulfonylamino]propanamide Traditional Name: (2S)-3-[4-(aminomethyl)phenyl]-N-cyclopentyl-N-methyl-2-[[5-(2-pyridyl)-2-thienyl]sulfonylamino]propionamide Formula: C25H30N4O3S2 MolecularWeight: 498.6607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC1)C(=O)C(CC2=CC=C(C=C2)CN)NS(=O)(=O)C3=CC=C(S3)C4=CC=CC=N4

Isomeric SMILES

CN(C1CCCC1)C(=O)[C@H](CC2=CC=C(C=C2)CN)NS(=O)(=O)C3=CC=C(S3)C4=CC=CC=N4

InChI

InChI=1S/C25H30N4O3S2/c1-29(20-6-2-3-7-20)25(30)22(16-18-9-11-19(17-26)12-10-18)28-34(31,32)24-14-13-23(33-24)21-8-4-5-15-27-21/h4-5,8-15,20,22,28H,2-3,6-7,16-17,26H2,1H3/t22-/m0/s1