5-chloranyl-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-propan-2-ylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[3-(2-furylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-isopropylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[3-[(2-furanylmethylamino)-oxomethyl]-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-(propan-2-ylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[3-(furan-2-ylmethylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-propan-2-ylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[3-(2-furfurylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]-2-(isopropylthio)pyrimidine-4-carboxamide Formula: C21H21ClN4O3S2 MolecularWeight: 476.99944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)NCC4=CC=CO4)Cl

Isomeric SMILES

CC(C)SC1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)NCC4=CC=CO4)Cl

InChI

InChI=1S/C21H21ClN4O3S2/c1-11(2)30-21-24-10-14(22)17(25-21)19(28)26-20-16(13-6-3-7-15(13)31-20)18(27)23-9-12-5-4-8-29-12/h4-5,8,10-11H,3,6-7,9H2,1-2H3,(H,23,27)(H,26,28)