3-[5-[(8R)-6-azanyl-9-bromanyl-8-methyl-2,3,4,9-tetrahydropyrimido[1,2-c]pyrimidin-8-yl]thiophen-3-yl]benzenecarbonitrile

Systemtic Name: 3-[5-[(8R)-6-azanyl-9-bromanyl-8-methyl-2,3,4,9-tetrahydropyrimido[1,2-c]pyrimidin-8-yl]thiophen-3-yl]benzenecarbonitrile Openeye Name: 3-[5-[(8R)-6-amino-9-bromo-8-methyl-2,3,4,9-tetrahydropyrimido[1,2-c]pyrimidin-8-yl]-3-thienyl]benzonitrile CAS Name: 3-[5-[(8R)-6-amino-9-bromo-8-methyl-2,3,4,9-tetrahydropyrimido[1,2-c]pyrimidin-8-yl]-3-thiophenyl]benzonitrile IUPAC Name: 3-[5-[(8R)-6-amino-9-bromo-8-methyl-2,3,4,9-tetrahydropyrimido[1,2-c]pyrimidin-8-yl]thiophen-3-yl]benzonitrile Traditional Name: 3-[5-[(8R)-6-amino-9-bromo-8-methyl-2,3,4,9-tetrahydropyrimido[1,2-c]pyrimidin-8-yl]-3-thienyl]benzonitrile Formula: C19H18BrN5S MolecularWeight: 428.34872

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=NCCCN2C(=N1)N)Br)C3=CC(=CS3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C[C@]1(C(C2=NCCCN2C(=N1)N)Br)C3=CC(=CS3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C19H18BrN5S/c1-19(16(20)17-23-6-3-7-25(17)18(22)24-19)15-9-14(11-26-15)13-5-2-4-12(8-13)10-21/h2,4-5,8-9,11,16H,3,6-7H2,1H3,(H2,22,24)/t16?,19-/m1/s1