N-[2-(4-methoxyphenyl)ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C21H19N3O2S/c1-26-17-7-4-15(5-8-17)10-11-22-20(25)16-6-9-18-19(14-16)27-21(23-18)24-12-2-3-13-24/h2-9,12-14H,10-11H2,1H3,(H,22,25)