N-(3-chloranyl-4-piperazin-1-yl-phenyl)-1-cyclopentyl-2,2-bis(oxidanylidene)pyrimido[4,5-c][1,2]thiazin-7-amine

Systemtic Name: N-(3-chloranyl-4-piperazin-1-yl-phenyl)-1-cyclopentyl-2,2-bis(oxidanylidene)pyrimido[4,5-c][1,2]thiazin-7-amine Openeye Name: N-(3-chloro-4-piperazin-1-yl-phenyl)-1-cyclopentyl-2,2-dioxo-pyrimido[4,5-c]thiazin-7-amine CAS Name: N-[3-chloro-4-(1-piperazinyl)phenyl]-1-cyclopentyl-2,2-dioxo-7-pyrimido[4,5-c]thiazinamine IUPAC Name: N-(3-chloro-4-piperazin-1-ylphenyl)-1-cyclopentyl-2,2-dioxopyrimido[4,5-c]thiazin-7-amine Traditional Name: (3-chloro-4-piperazino-phenyl)-(1-cyclopentyl-2,2-diketo-pyrimido[4,5-c]thiazin-7-yl)amine Formula: C21H25ClN6O2S MolecularWeight: 460.9802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=NC(=NC=C3C=CS2(=O)=O)NC4=CC(=C(C=C4)N5CCNCC5)Cl

Isomeric SMILES

C1CCC(C1)N2C3=NC(=NC=C3C=CS2(=O)=O)NC4=CC(=C(C=C4)N5CCNCC5)Cl

InChI

InChI=1S/C21H25ClN6O2S/c22-18-13-16(5-6-19(18)27-10-8-23-9-11-27)25-21-24-14-15-7-12-31(29,30)28(20(15)26-21)17-3-1-2-4-17/h5-7,12-14,17,23H,1-4,8-11H2,(H,24,25,26)