N-[3-methyl-1-oxidanylidene-1-[[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]amino]butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-[[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]amino]butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-methyl-1-[[6-(3-oxopiperazin-1-yl)-3-pyridyl]carbamoyl]propyl]thiophene-2-carboxamide CAS Name: N-[3-methyl-1-oxo-1-[[6-(3-oxo-1-piperazinyl)-3-pyridinyl]amino]butan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[3-methyl-1-oxo-1-[[6-(3-oxopiperazin-1-yl)pyridin-3-yl]amino]butan-2-yl]thiophene-2-carboxamide Traditional Name: N-[1-[[6-(3-ketopiperazino)-3-pyridyl]carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C19H23N5O3S MolecularWeight: 401.48262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CN=C(C=C1)N2CCNC(=O)C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(C(=O)NC1=CN=C(C=C1)N2CCNC(=O)C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C19H23N5O3S/c1-12(2)17(23-18(26)14-4-3-9-28-14)19(27)22-13-5-6-15(21-10-13)24-8-7-20-16(25)11-24/h3-6,9-10,12,17H,7-8,11H2,1-2H3,(H,20,25)(H,22,27)(H,23,26)