1-azanyl-3-(4-propan-2-ylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile

Systemtic Name: 1-azanyl-3-(4-propan-2-ylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile Openeye Name: 1-amino-3-(4-isopropylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile CAS Name: 1-amino-3-(4-propan-2-ylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile IUPAC Name: 1-amino-3-(4-propan-2-ylphenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile Traditional Name: 1-amino-3-p-cumenyl-3H-pyrido[2,1-b][1,3]benzothiazole-2,4-dicarbonitrile Formula: C22H18N4S MolecularWeight: 370.47012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2C(=C(N3C4=CC=CC=C4SC3=C2C#N)N)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2C(=C(N3C4=CC=CC=C4SC3=C2C#N)N)C#N

InChI

InChI=1S/C22H18N4S/c1-13(2)14-7-9-15(10-8-14)20-16(11-23)21(25)26-18-5-3-4-6-19(18)27-22(26)17(20)12-24/h3-10,13,20H,25H2,1-2H3