2-azanyl-3-pyrrolidin-1-yl-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]thiazepin-4-one

Systemtic Name: 2-azanyl-3-pyrrolidin-1-yl-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]thiazepin-4-one Openeye Name: 2-amino-3-pyrrolidin-1-yl-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]thiazepin-4-one CAS Name: 2-amino-3-(1-pyrrolidinyl)-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]thiazepin-4-one IUPAC Name: 2-amino-3-pyrrolidin-1-yl-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]thiazepin-4-one Traditional Name: 2-amino-3-pyrrolidino-6,7,8,9-tetrahydropyrimido[2,1-b][1,3]thiazepin-4-one Formula: C12H18N4OS MolecularWeight: 266.36252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(N=C3N(C2=O)CCCCS3)N

Isomeric SMILES

C1CCN(C1)C2=C(N=C3N(C2=O)CCCCS3)N

InChI

InChI=1S/C12H18N4OS/c13-10-9(15-5-1-2-6-15)11(17)16-7-3-4-8-18-12(16)14-10/h1-8,13H2