N-(2-dimethylaminoethyl)-3-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-3-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: N-(2-dimethylaminoethyl)-3-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: N-(2-dimethylaminoethyl)-3-[[[4-methyl-6-[methyl(propyl)amino]-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: N-(2-dimethylaminoethyl)-3-[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-(2-dimethylaminoethyl)-3-[[[4-methyl-6-[methyl(propyl)amino]pyrimidin-2-yl]thio]methyl]benzamide Formula: C21H31N5OS MolecularWeight: 401.56874

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C1=NC(=NC(=C1)C)SCC2=CC=CC(=C2)C(=O)NCCN(C)C

Isomeric SMILES

CCCN(C)C1=NC(=NC(=C1)C)SCC2=CC=CC(=C2)C(=O)NCCN(C)C

InChI

InChI=1S/C21H31N5OS/c1-6-11-26(5)19-13-16(2)23-21(24-19)28-15-17-8-7-9-18(14-17)20(27)22-10-12-25(3)4/h7-9,13-14H,6,10-12,15H2,1-5H3,(H,22,27)