5-[(2-azanyl-4-methyl-7-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-oxidanyl-2-phenethyl-2-propan-2-yl-3H-pyran-4-one

Systemtic Name: 5-[(2-azanyl-4-methyl-7-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-oxidanyl-2-phenethyl-2-propan-2-yl-3H-pyran-4-one Openeye Name: 5-[(2-amino-7-isopropyl-4-methyl-1,3-benzothiazol-6-yl)sulfanyl]-6-hydroxy-2-isopropyl-2-phenethyl-3H-pyran-4-one CAS Name: 5-[(2-amino-4-methyl-7-propan-2-yl-1,3-benzothiazol-6-yl)thio]-6-hydroxy-2-phenethyl-2-propan-2-yl-3H-pyran-4-one IUPAC Name: 5-[(2-amino-4-methyl-7-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-hydroxy-2-phenethyl-2-propan-2-yl-3H-pyran-4-one Traditional Name: 5-[(2-amino-7-isopropyl-4-methyl-1,3-benzothiazol-6-yl)thio]-6-hydroxy-2-isopropyl-2-phenethyl-3H-pyran-4-one Formula: C27H32N2O3S2 MolecularWeight: 496.68458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1N=C(S2)N)C(C)C)SC3=C(OC(CC3=O)(CCC4=CC=CC=C4)C(C)C)O

Isomeric SMILES

CC1=CC(=C(C2=C1N=C(S2)N)C(C)C)SC3=C(OC(CC3=O)(CCC4=CC=CC=C4)C(C)C)O

InChI

InChI=1S/C27H32N2O3S2/c1-15(2)21-20(13-17(5)22-24(21)34-26(28)29-22)33-23-19(30)14-27(16(3)4,32-25(23)31)12-11-18-9-7-6-8-10-18/h6-10,13,15-16,31H,11-12,14H2,1-5H3,(H2,28,29)