3-ethyl-4-(2-methylpiperidin-1-yl)-8-[1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-yl]chromen-2-one

Systemtic Name: 3-ethyl-4-(2-methylpiperidin-1-yl)-8-[1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-yl]chromen-2-one Openeye Name: 3-ethyl-4-(2-methyl-1-piperidyl)-8-[1-(thiazol-4-ylmethyl)benzimidazol-2-yl]chromen-2-one CAS Name: 3-ethyl-4-(2-methyl-1-piperidinyl)-8-[1-(4-thiazolylmethyl)-2-benzimidazolyl]-1-benzopyran-2-one IUPAC Name: 3-ethyl-4-(2-methylpiperidin-1-yl)-8-[1-(1,3-thiazol-4-ylmethyl)benzimidazol-2-yl]chromen-2-one Traditional Name: 3-ethyl-4-(2-methylpiperidino)-8-[1-(thiazol-4-ylmethyl)benzimidazol-2-yl]coumarin Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C(=CC=C2)C3=NC4=CC=CC=C4N3CC5=CSC=N5)OC1=O)N6CCCCC6C

Isomeric SMILES

CCC1=C(C2=C(C(=CC=C2)C3=NC4=CC=CC=C4N3CC5=CSC=N5)OC1=O)N6CCCCC6C

InChI

InChI=1S/C28H28N4O2S/c1-3-20-25(31-14-7-6-9-18(31)2)21-10-8-11-22(26(21)34-28(20)33)27-30-23-12-4-5-13-24(23)32(27)15-19-16-35-17-29-19/h4-5,8,10-13,16-18H,3,6-7,9,14-15H2,1-2H3