N-[3-(4-azanyl-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)propylcarbamothioyl]furan-2-carboxamide

Systemtic Name: N-[3-(4-azanyl-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)propylcarbamothioyl]furan-2-carboxamide Openeye Name: N-[3-(4-amino-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)propylcarbamothioyl]furan-2-carboxamide CAS Name: N-[[3-(4-amino-2,6,7-trimethyl-1-imidazo[4,5-c]pyridinyl)propylamino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[3-(4-amino-2,6,7-trimethylimidazo[4,5-c]pyridin-1-yl)propylcarbamothioyl]furan-2-carboxamide Traditional Name: N-[3-(4-amino-2,6,7-trimethyl-imidazo[4,5-c]pyridin-1-yl)propylthiocarbamoyl]-2-furamide Formula: C18H22N6O2S MolecularWeight: 386.47128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N=C1C)N)N=C(N2CCCNC(=S)NC(=O)C3=CC=CO3)C

Isomeric SMILES

CC1=C2C(=C(N=C1C)N)N=C(N2CCCNC(=S)NC(=O)C3=CC=CO3)C

InChI

InChI=1S/C18H22N6O2S/c1-10-11(2)21-16(19)14-15(10)24(12(3)22-14)8-5-7-20-18(27)23-17(25)13-6-4-9-26-13/h4,6,9H,5,7-8H2,1-3H3,(H2,19,21)(H2,20,23,25,27)