N-[2-[3-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[3-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[3-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[3-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-1-indolyl]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[3-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanylindol-1-yl]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[3-[[2-(2-furfurylamino)-2-keto-ethyl]thio]indol-1-yl]ethyl]thiophene-2-carboxamide Formula: C22H21N3O3S2 MolecularWeight: 439.55044

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=CS3)SCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCNC(=O)C3=CC=CS3)SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H21N3O3S2/c26-21(24-13-16-5-3-11-28-16)15-30-20-14-25(18-7-2-1-6-17(18)20)10-9-23-22(27)19-8-4-12-29-19/h1-8,11-12,14H,9-10,13,15H2,(H,23,27)(H,24,26)