4-chloranyl-N-[3-(furan-2-ylmethylcarbamoyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-N-[3-(furan-2-ylmethylcarbamoyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Openeye Name: 4-chloro-N-[3-(2-furylmethylcarbamoyl)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide CAS Name: 4-chloro-N-[3-[(2-furanylmethylamino)-oxomethyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-[3-(furan-2-ylmethylcarbamoyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylpyrazole-3-carboxamide Traditional Name: 4-chloro-N-[3-(2-furfurylcarbamoyl)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Formula: C20H21ClN4O3S MolecularWeight: 432.92374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C4=C(C=NN4C)Cl

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C4=C(C=NN4C)Cl

InChI

InChI=1S/C20H21ClN4O3S/c1-11-5-6-13-15(8-11)29-20(24-19(27)17-14(21)10-23-25(17)2)16(13)18(26)22-9-12-4-3-7-28-12/h3-4,7,10-11H,5-6,8-9H2,1-2H3,(H,22,26)(H,24,27)