5-[[7-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-[[7-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)-7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one CAS Name: 5-[[7-methyl-2-(2-methylpropylamino)-4-oxo-3-pyrido[1,2-a]pyrimidinyl]methylidene]-3-phenethyl-2-sulfanylidene-4-thiazolidinone IUPAC Name: 5-[[7-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-7-methyl-pyrido[1,2-a]pyrimidin-3-yl]methylene]-3-phenethyl-2-thioxo-thiazolidin-4-one Formula: C25H26N4O2S2 MolecularWeight: 478.62954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)NCC(C)C)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=C(C2=O)C=C3C(=O)N(C(=S)S3)CCC4=CC=CC=C4)NCC(C)C)C=C1

InChI

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