3-azanyl-4-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-phenylazanyl-thiophene-2-carboxamide

Systemtic Name: 3-azanyl-4-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-phenylazanyl-thiophene-2-carboxamide Openeye Name: 3-amino-5-anilino-4-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)thiophene-2-carboxamide CAS Name: 3-amino-5-anilino-4-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide IUPAC Name: 3-amino-5-anilino-4-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: 3-amino-5-anilino-4-cyano-N-(6-methoxy-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Formula: C20H15N5O2S2 MolecularWeight: 421.4954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C(=C(S3)NC4=CC=CC=C4)C#N)N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C(=C(S3)NC4=CC=CC=C4)C#N)N

InChI

InChI=1S/C20H15N5O2S2/c1-27-12-7-8-14-15(9-12)28-20(24-14)25-18(26)17-16(22)13(10-21)19(29-17)23-11-5-3-2-4-6-11/h2-9,23H,22H2,1H3,(H,24,25,26)