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

Systemtic Name: N-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxo-ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[2-[2-(2-methoxyphenyl)ethylamino]-2-oxoethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[2-keto-2-[2-(2-methoxyphenyl)ethylamino]ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNC(=O)CNC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CCNC(=O)CNC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C23H22N4O3S/c1-30-19-7-3-2-6-16(19)10-11-24-21(28)15-25-22(29)17-8-9-18-20(14-17)31-23(26-18)27-12-4-5-13-27/h2-9,12-14H,10-11,15H2,1H3,(H,24,28)(H,25,29)