3-(1,3-benzothiazol-2-yl)-6-ethyl-7-oxidanyl-8-(piperidin-1-ylmethyl)-2-propan-2-yl-chromen-4-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-6-ethyl-7-oxidanyl-8-(piperidin-1-ylmethyl)-2-propan-2-yl-chromen-4-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-2-isopropyl-8-(1-piperidylmethyl)chromen-4-one CAS Name: 3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-8-(1-piperidinylmethyl)-2-propan-2-yl-1-benzopyran-4-one IUPAC Name: 3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-8-(piperidin-1-ylmethyl)-2-propan-2-ylchromen-4-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-6-ethyl-7-hydroxy-2-isopropyl-8-(piperidinomethyl)chromone Formula: C27H30N2O3S MolecularWeight: 462.6037

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3)CN5CCCCC5)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3)CN5CCCCC5)O

InChI

InChI=1S/C27H30N2O3S/c1-4-17-14-18-24(31)22(27-28-20-10-6-7-11-21(20)33-27)25(16(2)3)32-26(18)19(23(17)30)15-29-12-8-5-9-13-29/h6-7,10-11,14,16,30H,4-5,8-9,12-13,15H2,1-3H3