3-[[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-amino]-N-(3-cyanothiophen-2-yl)propanamide

Systemtic Name: 3-[[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl]-ethyl-amino]-N-(3-cyanothiophen-2-yl)propanamide Openeye Name: 3-[[2-(4-acetamidoanilino)-2-oxo-ethyl]-ethyl-amino]-N-(3-cyano-2-thienyl)propanamide CAS Name: 3-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-(3-cyano-2-thiophenyl)propanamide IUPAC Name: 3-[[2-(4-acetamidoanilino)-2-oxoethyl]-ethylamino]-N-(3-cyanothiophen-2-yl)propanamide Traditional Name: 3-[[2-(4-acetamidoanilino)-2-keto-ethyl]-ethyl-amino]-N-(3-cyano-2-thienyl)propionamide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC(=O)NC1=C(C=CS1)C#N)CC(=O)NC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCN(CCC(=O)NC1=C(C=CS1)C#N)CC(=O)NC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C20H23N5O3S/c1-3-25(10-8-18(27)24-20-15(12-21)9-11-29-20)13-19(28)23-17-6-4-16(5-7-17)22-14(2)26/h4-7,9,11H,3,8,10,13H2,1-2H3,(H,22,26)(H,23,28)(H,24,27)