1-(ethylcarbamothioyl)-4-(3-methoxyphenyl)-N-methyl-N-(phenylmethyl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(ethylcarbamothioyl)-4-(3-methoxyphenyl)-N-methyl-N-(phenylmethyl)pyrrolidine-3-carboxamide Openeye Name: N-benzyl-1-(ethylcarbamothioyl)-4-(3-methoxyphenyl)-N-methyl-pyrrolidine-3-carboxamide CAS Name: 1-[ethylamino(sulfanylidene)methyl]-4-(3-methoxyphenyl)-N-methyl-N-(phenylmethyl)-3-pyrrolidinecarboxamide IUPAC Name: N-benzyl-1-(ethylcarbamothioyl)-4-(3-methoxyphenyl)-N-methylpyrrolidine-3-carboxamide Traditional Name: N-benzyl-1-(ethylthiocarbamoyl)-4-(3-methoxyphenyl)-N-methyl-pyrrolidine-3-carboxamide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CC(C(C1)C(=O)N(C)CC2=CC=CC=C2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCNC(=S)N1CC(C(C1)C(=O)N(C)CC2=CC=CC=C2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C23H29N3O2S/c1-4-24-23(29)26-15-20(18-11-8-12-19(13-18)28-3)21(16-26)22(27)25(2)14-17-9-6-5-7-10-17/h5-13,20-21H,4,14-16H2,1-3H3,(H,24,29)