4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-N-(2-methylsulfanylethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-N-(2-methylsulfanylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-N-(2-methylsulfanylethyl)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-N-[2-(methylthio)ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-N-(2-methylsulfanylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 4-[2-(1H-indol-3-yl)ethylamino]-5-methyl-N-[2-(methylthio)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H23N5OS2 MolecularWeight: 425.57022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC3=CNC4=CC=CC=C43)C(=O)NCCSC

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC3=CNC4=CC=CC=C43)C(=O)NCCSC

InChI

InChI=1S/C21H23N5OS2/c1-13-17-19(22-8-7-14-11-24-16-6-4-3-5-15(14)16)25-12-26-21(17)29-18(13)20(27)23-9-10-28-2/h3-6,11-12,24H,7-10H2,1-2H3,(H,23,27)(H,22,25,26)