4-[1-azanyl-2-(ethylcarbamothioylamino)ethyl]-N-pyridin-4-yl-benzamide

Systemtic Name: 4-[1-azanyl-2-(ethylcarbamothioylamino)ethyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-2-(ethylcarbamothioylamino)ethyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-2-[[ethylamino(sulfanylidene)methyl]amino]ethyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-2-(ethylcarbamothioylamino)ethyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-2-(ethylthiocarbamoylamino)ethyl]-N-(4-pyridyl)benzamide Formula: C17H21N5OS MolecularWeight: 343.44654

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NCC(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N

Isomeric SMILES

CCNC(=S)NCC(C1=CC=C(C=C1)C(=O)NC2=CC=NC=C2)N

InChI

InChI=1S/C17H21N5OS/c1-2-20-17(24)21-11-15(18)12-3-5-13(6-4-12)16(23)22-14-7-9-19-10-8-14/h3-10,15H,2,11,18H2,1H3,(H,19,22,23)(H2,20,21,24)