2-[2-[(4-cyanophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide

Systemtic Name: 2-[2-[(4-cyanophenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]-N-[2-(1H-indol-3-yl)ethyl]ethanamide Openeye Name: 2-[2-[(4-cyanophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide CAS Name: 2-[2-[(4-cyanophenyl)methylthio]-4-oxo-1H-pyrimidin-6-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide IUPAC Name: 2-[2-[(4-cyanophenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Traditional Name: 2-[2-[(4-cyanobenzyl)thio]-4-keto-1H-pyrimidin-6-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide Formula: C24H21N5O2S MolecularWeight: 443.52084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)CC3=CC(=O)N=C(N3)SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)CC3=CC(=O)N=C(N3)SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H21N5O2S/c25-13-16-5-7-17(8-6-16)15-32-24-28-19(12-23(31)29-24)11-22(30)26-10-9-18-14-27-21-4-2-1-3-20(18)21/h1-8,12,14,27H,9-11,15H2,(H,26,30)(H,28,29,31)