N-[3-[2-[(4-methylphenyl)methylsulfanyl]ethylamino]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[3-[2-[(4-methylphenyl)methylsulfanyl]ethylamino]-3-oxidanylidene-propyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: 4-oxo-N-[3-oxo-3-[2-(p-tolylmethylsulfanyl)ethylamino]propyl]-4-(2-thienyl)butanamide CAS Name: N-[3-[2-[(4-methylphenyl)methylthio]ethylamino]-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[3-[2-[(4-methylphenyl)methylsulfanyl]ethylamino]-3-oxopropyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: 4-keto-N-[3-keto-3-[2-[(4-methylbenzyl)thio]ethylamino]propyl]-4-(2-thienyl)butyramide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)CCNC(=O)CCC(=O)C2=CC=CS2

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)CCNC(=O)CCC(=O)C2=CC=CS2

InChI

InChI=1S/C21H26N2O3S2/c1-16-4-6-17(7-5-16)15-27-14-12-23-21(26)10-11-22-20(25)9-8-18(24)19-3-2-13-28-19/h2-7,13H,8-12,14-15H2,1H3,(H,22,25)(H,23,26)