N-(2-azanylethyl)-1-(2-methoxyethanoyl)-4-[(2-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(2-methoxyethanoyl)-4-[(2-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[o-tolylmethyl(2-thienylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-(2-methoxy-1-oxoethyl)-4-[(2-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[(2-methylphenyl)methyl-(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-1-(2-methoxyacetyl)-4-[(2-methylbenzyl)-(2-thenyl)amino]pyrrolidine-2-carboxamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC2=CC=CS2)C3CC(N(C3)C(=O)COC)C(=O)NCCN

Isomeric SMILES

CC1=CC=CC=C1CN(CC2=CC=CS2)C3CC(N(C3)C(=O)COC)C(=O)NCCN

InChI

InChI=1S/C23H32N4O3S/c1-17-6-3-4-7-18(17)13-26(15-20-8-5-11-31-20)19-12-21(23(29)25-10-9-24)27(14-19)22(28)16-30-2/h3-8,11,19,21H,9-10,12-16,24H2,1-2H3,(H,25,29)