N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-3-[phenyl(propyl)amino]propanamide

Systemtic Name: N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-3-[phenyl(propyl)amino]propanamide Openeye Name: N-[6-(diethylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-3-(N-propylanilino)propanamide CAS Name: N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-3-(N-propylanilino)propanamide IUPAC Name: N-[6-(diethylamino)-2-methyl-4-sulfanylidene-1H-pyrimidin-5-yl]-3-(N-propylanilino)propanamide Traditional Name: N-[6-(diethylamino)-2-methyl-4-thioxo-1H-pyrimidin-5-yl]-3-(N-propylanilino)propionamide Formula: C21H31N5OS MolecularWeight: 401.56874

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC(=O)NC1=C(NC(=NC1=S)C)N(CC)CC)C2=CC=CC=C2

Isomeric SMILES

CCCN(CCC(=O)NC1=C(NC(=NC1=S)C)N(CC)CC)C2=CC=CC=C2

InChI

InChI=1S/C21H31N5OS/c1-5-14-26(17-11-9-8-10-12-17)15-13-18(27)24-19-20(25(6-2)7-3)22-16(4)23-21(19)28/h8-12H,5-7,13-15H2,1-4H3,(H,24,27)(H,22,23,28)