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

Systemtic Name: N-(2-azanylethyl)-1-(4-methylphenyl)carbonyl-4-[2-methylpropanoyl(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-1-(4-methylbenzoyl)-4-[2-methylpropanoyl(2-thienylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-4-[(2-methyl-1-oxopropyl)-(thiophen-2-ylmethyl)amino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(4-methylbenzoyl)-4-[2-methylpropanoyl(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[isobutyryl(2-thenyl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C24H32N4O3S MolecularWeight: 456.60088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3=CC=CS3)C(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3=CC=CS3)C(=O)C(C)C

InChI

InChI=1S/C24H32N4O3S/c1-16(2)23(30)27(15-20-5-4-12-32-20)19-13-21(22(29)26-11-10-25)28(14-19)24(31)18-8-6-17(3)7-9-18/h4-9,12,16,19,21H,10-11,13-15,25H2,1-3H3,(H,26,29)