5-[[7-methyl-2-(2-methylpropylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[7-methyl-2-(2-methylpropylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-allyl-5-[[2-(isobutylamino)-7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-2-thioxo-thiazolidin-4-one CAS Name: 5-[[7-methyl-2-(2-methylpropylamino)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-3-prop-2-enyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[7-methyl-2-(2-methylpropylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-allyl-5-[[2-(isobutylamino)-4-keto-7-methyl-pyrido[1,2-a]pyrimidin-3-yl]methylene]-2-thioxo-thiazolidin-4-one Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC=C)NCC(C)C)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CC=C)NCC(C)C)C=C1

InChI

InChI=1S/C20H22N4O2S2/c1-5-8-23-19(26)15(28-20(23)27)9-14-17(21-10-12(2)3)22-16-7-6-13(4)11-24(16)18(14)25/h5-7,9,11-12,21H,1,8,10H2,2-4H3