N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(6-methyl-4-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(6-methyl-4-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-allyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(6-methyl-4-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[(6-methyl-4-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(5-allyl-4-keto-6-methyl-1H-pyrimidin-2-yl)thio]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide Formula: C24H22N4O2S2 MolecularWeight: 462.58708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CSC4=NC(=O)C(=C(N4)C)CC=C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CSC4=NC(=O)C(=C(N4)C)CC=C

InChI

InChI=1S/C24H22N4O2S2/c1-4-5-18-15(3)25-24(28-22(18)30)31-13-21(29)26-17-9-7-16(8-10-17)23-27-19-11-6-14(2)12-20(19)32-23/h4,6-12H,1,5,13H2,2-3H3,(H,26,29)(H,25,28,30)