N-[3-(2-azanyl-1,4-dimethyl-6-oxidanylidene-5H-pyrimidin-4-yl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[3-(2-azanyl-1,4-dimethyl-6-oxidanylidene-5H-pyrimidin-4-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[3-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)phenyl]benzothiophene-2-carboxamide CAS Name: N-[3-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[3-(2-amino-1,4-dimethyl-6-oxo-5H-pyrimidin-4-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[3-(2-amino-6-keto-1,4-dimethyl-5H-pyrimidin-4-yl)phenyl]benzothiophene-2-carboxamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)N(C(=N1)N)C)C2=CC(=CC=C2)NC(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CC1(CC(=O)N(C(=N1)N)C)C2=CC(=CC=C2)NC(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N4O2S/c1-21(12-18(26)25(2)20(22)24-21)14-7-5-8-15(11-14)23-19(27)17-10-13-6-3-4-9-16(13)28-17/h3-11H,12H2,1-2H3,(H2,22,24)(H,23,27)