2-[2-[bis(furan-2-ylmethyl)amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[2-[bis(furan-2-ylmethyl)amino]ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[[2-[bis(2-furylmethyl)amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[2-[bis(2-furanylmethyl)amino]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[[2-[bis(furan-2-ylmethyl)amino]acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[[2-[bis(2-furfuryl)amino]acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CN(CC3=CC=CO3)CC4=CC=CO4)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CN(CC3=CC=CO3)CC4=CC=CO4)C(=O)N

InChI

InChI=1S/C21H23N3O4S/c22-20(26)19-16-7-1-2-8-17(16)29-21(19)23-18(25)13-24(11-14-5-3-9-27-14)12-15-6-4-10-28-15/h3-6,9-10H,1-2,7-8,11-13H2,(H2,22,26)(H,23,25)