1-azanyl-2-(1,3-benzothiazol-2-yl)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile

Systemtic Name: 1-azanyl-2-(1,3-benzothiazol-2-yl)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Openeye Name: 1-amino-2-(1,3-benzothiazol-2-yl)-3-[5-(3,4-dichlorophenyl)-2-furyl]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile CAS Name: 1-amino-2-(1,3-benzothiazol-2-yl)-3-[5-(3,4-dichlorophenyl)-2-furanyl]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile IUPAC Name: 1-amino-2-(1,3-benzothiazol-2-yl)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Traditional Name: 1-amino-2-(1,3-benzothiazol-2-yl)-3-[5-(3,4-dichlorophenyl)-2-furyl]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Formula: C29H16Cl2N4OS2 MolecularWeight: 571.49954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(N4C5=CC=CC=C5SC4=C(C3C6=CC=C(O6)C7=CC(=C(C=C7)Cl)Cl)C#N)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(N4C5=CC=CC=C5SC4=C(C3C6=CC=C(O6)C7=CC(=C(C=C7)Cl)Cl)C#N)N

InChI

InChI=1S/C29H16Cl2N4OS2/c30-17-10-9-15(13-18(17)31)21-11-12-22(36-21)25-16(14-32)29-35(20-6-2-4-8-24(20)38-29)27(33)26(25)28-34-19-5-1-3-7-23(19)37-28/h1-13,25H,33H2