N-[5-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[5-[(3-aminocarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[5-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[5-[[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-oxomethyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[5-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[5-[(3-carbamoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]-2-methyl-phenyl]-2-furamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H21N3O4S/c1-12-8-9-13(11-15(12)24-21(28)16-6-4-10-29-16)20(27)25-22-18(19(23)26)14-5-2-3-7-17(14)30-22/h4,6,8-11H,2-3,5,7H2,1H3,(H2,23,26)(H,24,28)(H,25,27)