3-azanyl-N,4-bis(1,3-benzothiazol-2-yl)-5-[(2-methoxyphenyl)amino]thiophene-2-carboxamide

Systemtic Name: 3-azanyl-N,4-bis(1,3-benzothiazol-2-yl)-5-[(2-methoxyphenyl)amino]thiophene-2-carboxamide Openeye Name: 3-amino-N,4-bis(1,3-benzothiazol-2-yl)-5-(2-methoxyanilino)thiophene-2-carboxamide CAS Name: 3-amino-N,4-bis(1,3-benzothiazol-2-yl)-5-(2-methoxyanilino)-2-thiophenecarboxamide IUPAC Name: 3-amino-N,4-bis(1,3-benzothiazol-2-yl)-5-(2-methoxyanilino)thiophene-2-carboxamide Traditional Name: 3-amino-N,4-bis(1,3-benzothiazol-2-yl)-5-(o-anisidino)thiophene-2-carboxamide Formula: C26H19N5O2S3 MolecularWeight: 529.65636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=C(C(=C(S2)C(=O)NC3=NC4=CC=CC=C4S3)N)C5=NC6=CC=CC=C6S5

Isomeric SMILES

COC1=CC=CC=C1NC2=C(C(=C(S2)C(=O)NC3=NC4=CC=CC=C4S3)N)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C26H19N5O2S3/c1-33-17-11-5-2-8-14(17)28-25-20(24-29-15-9-3-6-12-18(15)34-24)21(27)22(36-25)23(32)31-26-30-16-10-4-7-13-19(16)35-26/h2-13,28H,27H2,1H3,(H,30,31,32)