5-[[9-methyl-2-(2-methylpropylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 5-[[9-methyl-2-(2-methylpropylamino)-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 5-[[2-(isobutylamino)-9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[9-methyl-2-(2-methylpropylamino)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-3-phenethyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[9-methyl-2-(2-methylpropylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-phenethyl-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 5-[[2-(isobutylamino)-4-keto-9-methyl-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one Formula: C25H26N4O2S2 MolecularWeight: 478.62954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)NCC(C)C

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)NCC(C)C

InChI

InChI=1S/C25H26N4O2S2/c1-16(2)15-26-21-19(23(30)28-12-7-8-17(3)22(28)27-21)14-20-24(31)29(25(32)33-20)13-11-18-9-5-4-6-10-18/h4-10,12,14,16,26H,11,13,15H2,1-3H3