4-[[[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-amino]methyl]benzamide

Systemtic Name: 4-[[[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-cyclopropyl-amino]methyl]benzamide Openeye Name: 4-[[[2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl]-cyclopropyl-amino]methyl]benzamide CAS Name: 4-[[[2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl]-cyclopropylamino]methyl]benzamide IUPAC Name: 4-[[[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]-cyclopropylamino]methyl]benzamide Traditional Name: 4-[[[2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl]-cyclopropyl-amino]methyl]benzamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)C(=O)N)CC(=O)NC3=C(C=CS3)C#N

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)C(=O)N)CC(=O)NC3=C(C=CS3)C#N

InChI

InChI=1S/C18H18N4O2S/c19-9-14-7-8-25-18(14)21-16(23)11-22(15-5-6-15)10-12-1-3-13(4-2-12)17(20)24/h1-4,7-8,15H,5-6,10-11H2,(H2,20,24)(H,21,23)