N-[5-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[5-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[5-[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1-carbonyl]-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[5-[[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-oxomethyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[5-[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1-carbonyl]-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[5-[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1-carbonyl]-2-methyl-phenyl]-2-furamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3)NC(=O)C5=CC=CO5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4S3)NC(=O)C5=CC=CO5

InChI

InChI=1S/C25H24N4O3S/c1-17-8-9-18(15-20(17)27-24(30)21-6-4-14-32-21)25(31)29-12-10-28(11-13-29)16-23-26-19-5-2-3-7-22(19)33-23/h2-9,14-15H,10-13,16H2,1H3,(H,27,30)