2-(1,3-benzothiazol-2-yl)-3-(2,4-dichlorophenyl)-1-[(E)-(phenylmethylidene)amino]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-3-(2,4-dichlorophenyl)-1-[(E)-(phenylmethylidene)amino]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-1-[(E)-benzylideneamino]-3-(2,4-dichlorophenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-3-(2,4-dichlorophenyl)-1-[(E)-(phenylmethylene)amino]-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-1-[(E)-benzylideneamino]-3-(2,4-dichlorophenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Traditional Name: 1-[(E)-benzalamino]-2-(1,3-benzothiazol-2-yl)-3-(2,4-dichlorophenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile Formula: C32H18Cl2N4S2 MolecularWeight: 593.54812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=NC2=C(C(C(=C3N2C4=CC=CC=C4S3)C#N)C5=C(C=C(C=C5)Cl)Cl)C6=NC7=CC=CC=C7S6

Isomeric SMILES

C1=CC=C(C=C1)/C=N/C2=C(C(C(=C3N2C4=CC=CC=C4S3)C#N)C5=C(C=C(C=C5)Cl)Cl)C6=NC7=CC=CC=C7S6

InChI

InChI=1S/C32H18Cl2N4S2/c33-20-14-15-21(23(34)16-20)28-22(17-35)32-38(25-11-5-7-13-27(25)40-32)30(36-18-19-8-2-1-3-9-19)29(28)31-37-24-10-4-6-12-26(24)39-31/h1-16,18,28H/b36-18+