methyl (Z)-3-[4-(dipropylamino)phenyl]-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate

Systemtic Name: methyl (Z)-3-[4-(dipropylamino)phenyl]-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Openeye Name: methyl (Z)-3-[4-(dipropylamino)phenyl]-2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)prop-2-enoate CAS Name: (Z)-3-[4-(dipropylamino)phenyl]-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-[4-(dipropylamino)phenyl]-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Traditional Name: (Z)-3-[4-(dipropylamino)phenyl]-2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acrylic acid methyl ester Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=CC=C(C=C1)C=C(C2=CC(=O)NC(=S)N2)C(=O)OC

Isomeric SMILES

CCCN(CCC)C1=CC=C(C=C1)/C=C(/C2=CC(=O)NC(=S)N2)\C(=O)OC

InChI

InChI=1S/C20H25N3O3S/c1-4-10-23(11-5-2)15-8-6-14(7-9-15)12-16(19(25)26-3)17-13-18(24)22-20(27)21-17/h6-9,12-13H,4-5,10-11H2,1-3H3,(H2,21,22,24,27)/b16-12-