N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-pyrrol-1-yl-thiophene-2-carboxamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-pyrrol-1-yl-thiophene-2-carboxamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-pyrrol-1-yl-thiophene-2-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(1-pyrrolyl)-2-thiophenecarboxamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-pyrrol-1-ylthiophene-2-carboxamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-pyrrol-1-yl-thiophene-2-carboxamide Formula: C18H15N3OS2 MolecularWeight: 353.4612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CS3)N4C=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CS3)N4C=CC=C4)C

InChI

InChI=1S/C18H15N3OS2/c1-11-9-12(2)15-14(10-11)24-18(19-15)20-17(22)16-13(5-8-23-16)21-6-3-4-7-21/h3-10H,1-2H3,(H,19,20,22)