N-(2-oxidanylidene-2-thiomorpholin-4-yl-ethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-oxidanylidene-2-thiomorpholin-4-yl-ethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-oxo-2-thiomorpholino-ethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-oxo-2-thiomorpholin-4-ylethyl)-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-oxo-2-thiomorpholin-4-ylethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-keto-2-thiomorpholino-ethyl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C(=O)CNC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

C1CSCCN1C(=O)CNC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C18H18N4O2S2/c23-16(21-7-9-25-10-8-21)12-19-17(24)13-3-4-14-15(11-13)26-18(20-14)22-5-1-2-6-22/h1-6,11H,7-10,12H2,(H,19,24)