4-[[4-(1-benzothiophen-2-yl)pyrimidin-2-yl]amino]-N-(3-methylbutyl)benzamide

Systemtic Name: 4-[[4-(1-benzothiophen-2-yl)pyrimidin-2-yl]amino]-N-(3-methylbutyl)benzamide Openeye Name: 4-[[4-(benzothiophen-2-yl)pyrimidin-2-yl]amino]-N-isopentyl-benzamide CAS Name: 4-[[4-(1-benzothiophen-2-yl)-2-pyrimidinyl]amino]-N-(3-methylbutyl)benzamide IUPAC Name: 4-[[4-(1-benzothiophen-2-yl)pyrimidin-2-yl]amino]-N-(3-methylbutyl)benzamide Traditional Name: 4-[[4-(benzothiophen-2-yl)pyrimidin-2-yl]amino]-N-isoamyl-benzamide Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CC(C)CCNC(=O)C1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C24H24N4OS/c1-16(2)11-13-25-23(29)17-7-9-19(10-8-17)27-24-26-14-12-20(28-24)22-15-18-5-3-4-6-21(18)30-22/h3-10,12,14-16H,11,13H2,1-2H3,(H,25,29)(H,26,27,28)