3-(3-indol-1-ylpropyl)-1-methyl-1-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]urea

Systemtic Name: 3-(3-indol-1-ylpropyl)-1-methyl-1-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]urea Openeye Name: 3-(3-indol-1-ylpropyl)-1-methyl-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]urea CAS Name: 3-[3-(1-indolyl)propyl]-1-methyl-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]urea IUPAC Name: 3-(3-indol-1-ylpropyl)-1-methyl-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]urea Traditional Name: 3-(3-indol-1-ylpropyl)-1-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-1-methyl-urea Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=C(N1)C=CS2)C(=O)NCCCN3C=CC4=CC=CC=C43

Isomeric SMILES

CN(CC1=NC(=O)C2=C(N1)C=CS2)C(=O)NCCCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C20H21N5O2S/c1-24(13-17-22-15-8-12-28-18(15)19(26)23-17)20(27)21-9-4-10-25-11-7-14-5-2-3-6-16(14)25/h2-3,5-8,11-12H,4,9-10,13H2,1H3,(H,21,27)(H,22,23,26)