2-[7-ethyl-3-[[1-(furan-2-ylmethyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]ethanamide

Systemtic Name: 2-[7-ethyl-3-[[1-(furan-2-ylmethyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]ethanamide Openeye Name: 2-[7-ethyl-3-[[1-(2-furylmethyl)-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]indol-1-yl]acetamide CAS Name: 2-[7-ethyl-3-[[1-(2-furanylmethyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-1-indolyl]acetamide IUPAC Name: 2-[7-ethyl-3-[[1-(furan-2-ylmethyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]indol-1-yl]acetamide Traditional Name: 2-[7-ethyl-3-[[1-(2-furfuryl)-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene]methyl]indol-1-yl]acetamide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1N(C=C2C=C3C(=O)NC(=S)N(C3=O)CC4=CC=CO4)CC(=O)N

Isomeric SMILES

CCC1=CC=CC2=C1N(C=C2C=C3C(=O)NC(=S)N(C3=O)CC4=CC=CO4)CC(=O)N

InChI

InChI=1S/C22H20N4O4S/c1-2-13-5-3-7-16-14(10-25(19(13)16)12-18(23)27)9-17-20(28)24-22(31)26(21(17)29)11-15-6-4-8-30-15/h3-10H,2,11-12H2,1H3,(H2,23,27)(H,24,28,31)