2-[methylsulfonyl(2-pyrrolidin-1-ylethyl)amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[methylsulfonyl(2-pyrrolidin-1-ylethyl)amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[methylsulfonyl(2-pyrrolidin-1-ylethyl)amino]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[methylsulfonyl-[2-(1-pyrrolidinyl)ethyl]amino]-N-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[methylsulfonyl(2-pyrrolidin-1-ylethyl)amino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[mesyl(2-pyrrolidinoethyl)amino]-N-[(3-methyl-2-thienyl)methyl]acetamide Formula: C22H31N3O3S2 MolecularWeight: 449.62984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CC2=CC=CC=C2)C(=O)CN(CCN3CCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=C(SC=C1)CN(CC2=CC=CC=C2)C(=O)CN(CCN3CCCC3)S(=O)(=O)C

InChI

InChI=1S/C22H31N3O3S2/c1-19-10-15-29-21(19)17-24(16-20-8-4-3-5-9-20)22(26)18-25(30(2,27)28)14-13-23-11-6-7-12-23/h3-5,8-10,15H,6-7,11-14,16-18H2,1-2H3