[3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-propyl]-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: [3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-propyl]-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: [3-[(3-cyano-2-thienyl)amino]-3-oxo-propyl]-[2-(isopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [3-[(3-cyano-2-thiophenyl)amino]-3-oxopropyl]-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: [3-[(3-cyanothiophen-2-yl)amino]-3-oxopropyl]-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [3-[(3-cyano-2-thienyl)amino]-3-keto-propyl]-[2-(isopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C14H21N4O2S+ MolecularWeight: 309.40714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+](C)CCC(=O)NC1=C(C=CS1)C#N

Isomeric SMILES

CC(C)NC(=O)C[NH+](C)CCC(=O)NC1=C(C=CS1)C#N

InChI

InChI=1S/C14H20N4O2S/c1-10(2)16-13(20)9-18(3)6-4-12(19)17-14-11(8-15)5-7-21-14/h5,7,10H,4,6,9H2,1-3H3,(H,16,20)(H,17,19)/p+1