4-[decyl(phenyl)amino]-N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]butanamide

Systemtic Name: 4-[decyl(phenyl)amino]-N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]butanamide Openeye Name: 4-(N-decylanilino)-N-[6-(diethylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]butanamide CAS Name: 4-(N-decylanilino)-N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]butanamide IUPAC Name: 4-(N-decylanilino)-N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]butanamide Traditional Name: 4-(N-decylanilino)-N-[6-(diethylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]butyramide Formula: C29H47N5OS MolecularWeight: 513.78138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN(CCCC(=O)NC1=C(NC(=NC1=S)C)N(CC)CC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCN(CCCC(=O)NC1=C(NC(=NC1=S)C)N(CC)CC)C2=CC=CC=C2

InChI

InChI=1S/C29H47N5OS/c1-5-8-9-10-11-12-13-17-22-34(25-19-15-14-16-20-25)23-18-21-26(35)32-27-28(33(6-2)7-3)30-24(4)31-29(27)36/h14-16,19-20H,5-13,17-18,21-23H2,1-4H3,(H,32,35)(H,30,31,36)