2-[1-[4-(carbamothioylamino)phenyl]carbonylpiperidin-4-yl]-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide

Systemtic Name: 2-[1-[4-(carbamothioylamino)phenyl]carbonylpiperidin-4-yl]-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide Openeye Name: 2-[1-[4-(carbamothioylamino)benzoyl]-4-piperidyl]-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide CAS Name: 2-[1-[[4-(carbamothioylamino)phenyl]-oxomethyl]-4-piperidinyl]-6-methyl-N-(2-propoxyethyl)-3-pyridinecarboxamide IUPAC Name: 2-[1-[4-(carbamothioylamino)benzoyl]piperidin-4-yl]-6-methyl-N-(2-propoxyethyl)pyridine-3-carboxamide Traditional Name: 6-methyl-N-(2-propoxyethyl)-2-[1-(4-thioureidobenzoyl)-4-piperidyl]nicotinamide Formula: C25H33N5O3S MolecularWeight: 483.62622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOCCNC(=O)C1=C(N=C(C=C1)C)C2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=S)N

Isomeric SMILES

CCCOCCNC(=O)C1=C(N=C(C=C1)C)C2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=S)N

InChI

InChI=1S/C25H33N5O3S/c1-3-15-33-16-12-27-23(31)21-9-4-17(2)28-22(21)18-10-13-30(14-11-18)24(32)19-5-7-20(8-6-19)29-25(26)34/h4-9,18H,3,10-16H2,1-2H3,(H,27,31)(H3,26,29,34)