N-(2-azanylethyl)-4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-ethanoyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-1-ethanoyl-pyrrolidine-2-carboxamide Openeye Name: 1-acetyl-N-(2-aminoethyl)-4-[cyclohexylmethyl(2-thienylmethyl)amino]pyrrolidine-2-carboxamide CAS Name: 1-acetyl-N-(2-aminoethyl)-4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]-2-pyrrolidinecarboxamide IUPAC Name: 1-acetyl-N-(2-aminoethyl)-4-[cyclohexylmethyl(thiophen-2-ylmethyl)amino]pyrrolidine-2-carboxamide Traditional Name: 1-acetyl-N-(2-aminoethyl)-4-[cyclohexylmethyl(2-thenyl)amino]pyrrolidine-2-carboxamide Formula: C21H34N4O2S MolecularWeight: 406.58526

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(CC1C(=O)NCCN)N(CC2CCCCC2)CC3=CC=CS3

Isomeric SMILES

CC(=O)N1CC(CC1C(=O)NCCN)N(CC2CCCCC2)CC3=CC=CS3

InChI

InChI=1S/C21H34N4O2S/c1-16(26)25-14-18(12-20(25)21(27)23-10-9-22)24(15-19-8-5-11-28-19)13-17-6-3-2-4-7-17/h5,8,11,17-18,20H,2-4,6-7,9-10,12-15,22H2,1H3,(H,23,27)