(6S)-3-[(2-azanyl-5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-phenethyl-6-propan-2-yl-oxane-2,4-dione

Systemtic Name: (6S)-3-[(2-azanyl-5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-phenethyl-6-propan-2-yl-oxane-2,4-dione Openeye Name: (6S)-3-[(2-amino-5-isopropyl-1,3-benzothiazol-6-yl)sulfanyl]-6-isopropyl-6-phenethyl-tetrahydropyran-2,4-dione CAS Name: (6S)-3-[(2-amino-5-propan-2-yl-1,3-benzothiazol-6-yl)thio]-6-phenethyl-6-propan-2-yloxane-2,4-dione IUPAC Name: (6S)-3-[(2-amino-5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-phenethyl-6-propan-2-yloxane-2,4-dione Traditional Name: (6S)-3-[(2-amino-5-isopropyl-1,3-benzothiazol-6-yl)thio]-6-isopropyl-6-phenethyl-tetrahydropyran-2,4-quinone Formula: C26H30N2O3S2 MolecularWeight: 482.658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1SC3C(=O)CC(OC3=O)(CCC4=CC=CC=C4)C(C)C)SC(=N2)N

Isomeric SMILES

CC(C)C1=CC2=C(C=C1SC3C(=O)C[C@@](OC3=O)(CCC4=CC=CC=C4)C(C)C)SC(=N2)N

InChI

InChI=1S/C26H30N2O3S2/c1-15(2)18-12-19-22(33-25(27)28-19)13-21(18)32-23-20(29)14-26(16(3)4,31-24(23)30)11-10-17-8-6-5-7-9-17/h5-9,12-13,15-16,23H,10-11,14H2,1-4H3,(H2,27,28)/t23?,26-/m0/s1